SCHEMBL742957

SCHEMBL742957

COCCNc1ccccc1N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.54
NCF1 P14598 2/20 0.53
MAPT P10636 5/20 0.47
ALDH1A1 P00352 4/20 0.47
KCNH3 Q9ULD8 1/20 0.44
UTS2R Q9UKP6 1/20 0.43
MALT1 Q9UDY8 1/20 0.42
KDM4E B2RXH2 3/20 0.42
GAA P10253 3/20 0.42
HTT P42858 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
THRB P10828 1/20 0.42
RECQL P46063 1/20 0.42
MMP14 P50281 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HDAC3 O15379 2/20 0.41
HDAC1 Q13547 2/20 0.41

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
Hydrochloric Acid SCHEMBL11314258 0.98 PTGER4 (0.53) PTGER4NCF1MAPTALDH1A1KCNH3
SCHEMBL18394468 0.90 PTGER4 (0.46) PTGER4NCF1MAPTALDH1A1KCNH3
SCHEMBL7745287 0.89 PTGER4 (0.51) PTGER4NCF1MAPTALDH1A1KCNH3
SCHEMBL1421397 0.87 PTGER4 (0.47) PTGER4NCF1MAPTALDH1A1KCNH3
SCHEMBL7734442 0.86 NCF1 (0.56) PTGER4NCF1MAPTALDH1A1KCNH3
SCHEMBL2547601 0.84 MAPT (0.63) PTGER4MAPTALDH1A1GAAHTT
SCHEMBL8720377 0.82 HDAC3 (0.41) PTGER4NCF1MAPTALDH1A1KDM4E
SCHEMBL10498572 0.81 PTGER4 (0.40) PTGER4NCF1MAPTALDH1A1UTS2R
SCHEMBL6201094 0.81 MAPT (0.52) MAPTALDH1A1KDM4EGAAHTT
SCHEMBL20797652 0.80 NCF1 (0.39) PTGER4NCF1MAPTALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007026312-A1 1,3-DIAMINOBENZENE DERIVATIVES AND COLORANTS COMPRISING THESE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2007-03-08 WO claimed
US-20230234943-A1 TREX1 INHIBITORS AND USES THEREOF TEMPEST THERAPEUTICS, INC. 2023-07-27 US disclosed
US-20230234943-A1 TREX1 INHIBITORS AND USES THEREOF TEMPEST THERAPEUTICS, INC. 2023-07-27 US disclosed
US-20230234943-A1 TREX1 INHIBITORS AND USES THEREOF TEMPEST THERAPEUTICS, INC. 2023-07-27 US disclosed
WO-2021263079-A1 TREX1 INHIBITORS AND USES THEREOF TEMPEST THERAPEUTICS, INC. (US) 2021-12-30 WO disclosed
WO-2021263079-A1 TREX1 INHIBITORS AND USES THEREOF TEMPEST THERAPEUTICS, INC. (US) 2021-12-30 WO disclosed
US-10590088-B2 4-(benzimidazol-2-ylamino)benzamide derivatives and methods of synthesis thereof TRANSLATIONAL DRUG DEVELOPMENT, LLC (US) 2020-03-17 US disclosed
US-20190084940-A1 BENZAMIDE DERIVATIVES TRANSLATIONAL DRUG DEVELOPMENT, LLC 2019-03-21 US disclosed
WO-2019049061-A1 5-(1 H-BENZO[D]IMIDAZO-2-YL)-PYRIDIN-2-AMINE AND 5-(3H-IMIDAZO[4,5-B]PYRIDIN-6-YL)-PYRIDIN-2-AMINE DERIVATIVES AS C-MYC AND P300/CBP HISTONE ACETYLTRANSFERASE INHIBITORS FOR TREATING CANCER GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-03-14 WO disclosed
US-20170253565-A1 OPIOID AGONISTS AND USES THEREOF NEKTAR THERAPEUTICS 2017-09-07 US disclosed
US-8138168-B1 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-20 US disclosed
WO-2011123609-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-10-06 WO disclosed
WO-2011123609-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-10-06 WO disclosed
US-6506738-B1 Treatment of viral infections. More particularly, the invention provides benzimidazolone derivatives for the treatment of respiratory syncytial virus infection. BRISTOL-MYERS SQUIBB COMPANY 2003-01-14 US disclosed
US-20020164741-A1 Non-aqueous, liquid, enzyme-containing compositions NOVOZYMES A/S (DK) 2002-11-07 US disclosed
WO-2002026228-A1 BENZIMIDAZOLONE ANTIVIRAL AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-04-04 WO disclosed
US-5686449-A 1,5-benzodiazepines useful as gastrinor CCK-antagonists GLAXO WELLCOME S.P.A. (IT) 1997-11-11 US disclosed
US-4408072-A Amido methoxyethylamines AMERICAN CYANAMID COMPANY (US) 1983-10-04 US disclosed
US-4314079-A Novel methoxyethylamine AMERICAN CYANAMID COMPANY (US) 1982-02-02 US disclosed
US-3981677-A Oxidative hair dye compositions containing N-substituted o-phenylenediamines and method for their use CLAIROL INCORPORATED (US) 1976-09-21 US 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 (5 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-20230234943-A1 TREX1 INHIBITORS AND USES THEREOF FEN1, ERCC4, DCLRE1B PTGER4 3400/4885NCF1 766/4885MAPT 3694/4885
US-20020164741-A1 Non-aqueous, liquid, enzyme-containing compositions CNDP2, NOTUM, BCHE PTGER4 3211/4885NCF1 1124/4885MAPT 2583/4885
US-20170253565-A1 OPIOID AGONISTS AND USES THEREOF OPRM1, OPRK1, OPRD1 PTGER4 249/4885NCF1 3630/4885MAPT 914/4885
US-10590088-B2 4-(benzimidazol-2-ylamino)benzamide derivatives and methods of synthesis thereof MCL1, BRDT, BOD1L1 PTGER4 3104/4885NCF1 1839/4885MAPT 4683/4885
US-20190084940-A1 BENZAMIDE DERIVATIVES BRDT, BRD3, BRD2 PTGER4 4278/4885NCF1 1645/4885MAPT 4124/4885

“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.