SCHEMBL392810

SCHEMBL392810

N#Cc1ccccc1C(=O)CBr

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.50
GSK3B P49841 4/20 0.47
HPGDS O60760 1/20 0.40
PPIA P62937 1/20 0.40
POLB P06746 2/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HTT P42858 1/20 0.38
GAA P10253 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1360356 0.84 GSK3B (0.46) PTPN1GSK3BHPGDSPOLBMAPT
SCHEMBL26657030 0.82 HPGDS (0.43) PTPN1GSK3BHPGDSMAPTLMNA
SCHEMBL29777919 0.81 TSHR (0.52) PPIAPOLBMAPTLMNAGAA
SCHEMBL27576279 0.81 MAPT (0.42) PPIAPOLBMAPTLMNAGAA
SCHEMBL8239082 0.81 TSHR (0.52) PPIAPOLBMAPTLMNAGAA
SCHEMBL9409754 0.79 PTPN1 (0.65) PTPN1GSK3BHPGDSMAPTMEN1
SCHEMBL28662371 0.78 TSHR (0.39) PPIAPOLBMAPTLMNAGAA
SCHEMBL2558412 0.78 PPIA (0.38) PPIAPOLBMAPTLMNAHTT
SCHEMBL31575826 0.78 PPIA (0.43) PPIAPOLBMAPTLMNAMEN1
SCHEMBL31000747 0.77 PPIA (0.45) PPIAPOLBMAPTLMNAGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219486-A1 NOVEL BRIDGED BICYCLOALKYL-SUBSTITUTED AMINOTHIZOLES AND THEIR METHODS OF USE Temple University of the Commonwealth System of Higher Education (US) 2023-08-02 EP disclosed
EP-4219486-A1 NOVEL BRIDGED BICYCLOALKYL-SUBSTITUTED AMINOTHIZOLES AND THEIR METHODS OF USE Temple University of the Commonwealth System of Higher Education (US) 2023-08-02 EP disclosed
EP-3571196-B1 NOVEL BRIDGED BICYCLOALKYL-SUBSTITUTED AMINOTHIZOLES AND THEIR METHODS OF USE UNIV TEMPLE (US) 2023-01-04 EP disclosed
EP-3571196-B1 NOVEL BRIDGED BICYCLOALKYL-SUBSTITUTED AMINOTHIZOLES AND THEIR METHODS OF USE UNIV TEMPLE (US) 2023-01-04 EP disclosed
US-10941126-B2 Bridged bicycloalkyl-substituted aminothiazoles and their methods of use TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2021-03-09 US disclosed
US-10941126-B2 Bridged bicycloalkyl-substituted aminothiazoles and their methods of use TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2021-03-09 US disclosed
US-20190352272-A1 Novel Bridged Bicycloalkyl-Substituted Aminothiazoles and Their Methods of Use TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2019-11-21 US disclosed
US-20190352272-A1 Novel Bridged Bicycloalkyl-Substituted Aminothiazoles and Their Methods of Use TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2019-11-21 US disclosed
US-10112936-B2 Five-membered heterocycles useful as serine protease inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2018-10-30 US disclosed
WO-2018136766-A1 NOVEL BRIDGED BICYCLOALKYL-SUBSTITUTED AMINOTHIZOLES AND THEIR METHODS OF USE TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2018-07-26 WO disclosed
US-20080146632-A1 Fc Receptor Modulating Compounds and Compositions TRILLIUM THERAPEUTICS, INC. (CA) 2008-06-19 US disclosed
US-7332631-B2 These compounds typically have a core lipophilic group, substituted with a group rich in pi -electrons, preferably having a delocalised pi -electron system; typically include at least one acidic group having a pi -electron system; Autoimmune diseases TRILLIUM THERAPEUTICS INC. (CA) 2008-02-19 US disclosed
CN-101006063-A Five-membered heterocycles useful as serine protease inhibitors. BRISTOL MYERS SQUIBB CO (US) 2007-07-25 CN disclosed
EP-1773786-A2 FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS Bristol-Myers Squibb Company (US) 2007-04-18 EP disclosed
US-20060264484-A1 Fc receptor modulating compounds and compositions THE MACFARLANE BURNET INSTITUTE FOR MEDICAL RESEARCH AND PUBLIC HEALTH LTD (AU) 2006-11-23 US disclosed
WO-2005123050-A2 FIVE-MEMBERED HETEROCYCLES USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-12-29 WO disclosed
US-20050282805-A1 thrombotic or an inflammatory disorders; improved factor XIa and/or plasma kallikrein inhibitory activity and selectivity, dosage requirment, costs or feasibility, side effect reduction; 4-(aminomethyl)-N-[2-phenyl-1-(4-pyridin-2-yl-1H-imidazol-2-yl)ethyl]-trans-cyclohexanecarboxamide BRISTOL-MYERS SQUIBB COMPANY 2005-12-22 US disclosed
EP-1585745-A1 FC RECEPTOR MODULATING COMPOUNDS AND COMPOSITIONS Arthron Limited (AU) 2005-10-19 EP disclosed
US-20050009894-A1 Benzimidazole derivatives and their use as KDR kinase protein inhibitors AVENTIS PHARMA S.A. (FR) 2005-01-13 US disclosed
WO-2004058747-A1 FC RECEPTOR MODULATING COMPOUNDS AND COMPOSITIONS ARTHRON LIMITED (AU) 2004-07-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10112936-B2 Five-membered heterocycles useful as serine protease inhibitors F12, F11, F5 PTPN1 1612/4885GSK3B 846/4885HPGDS 910/4885
US-20080146632-A1 Fc Receptor Modulating Compounds and Compositions FCGR1A, FCGR2A, FCGR3B PTPN1 470/4885GSK3B 4284/4885HPGDS 832/4885
US-20060264484-A1 Fc receptor modulating compounds and compositions FCGR1A, FCGR2A, FCGR3B PTPN1 448/4885GSK3B 4455/4885HPGDS 824/4885
US-20050009894-A1 Benzimidazole derivatives and their use as KDR kinase protein inhibitors KDR, MUSK, FLT4 PTPN1 1784/4885GSK3B 430/4885HPGDS 2192/4885
US-10941126-B2 Bridged bicycloalkyl-substituted aminothiazoles and their methods of use BRCA1, AADAC, BCAT1 PTPN1 3661/4885GSK3B 3445/4885HPGDS 1036/4885
US-20190352272-A1 Novel Bridged Bicycloalkyl-Substituted Aminothiazoles and Their Methods of Use BRCA1, AADAC, BRDT PTPN1 3825/4885GSK3B 3742/4885HPGDS 1182/4885
US-20050282805-A1 thrombotic or an inflammatory disorders; improved factor XIa and/or plasma kallikrein inhibitory activity and selectivity, dosage requirment, costs or feasibility, side effect reduction; 4-(aminomethyl)-N-[2-phenyl-1-(4-pyridin-2-yl-1H-imidazol-2-yl)ethyl]-trans-cyclohexanecarboxamide F11, TFPI, F12 PTPN1 2563/4885GSK3B 1316/4885HPGDS 1787/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.