SCHEMBL850770

SCHEMBL850770

O=Cc1cnc(-c2ccc(Cl)cc2)s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.51
MAPT P10636 3/20 0.51
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
PPARG P37231 2/20 0.48
NCOA2 Q15596 2/20 0.48
NCOA1 Q15788 2/20 0.48
NCOA3 Q9Y6Q9 2/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
ALDH1A1 P00352 7/20 0.47
HPGD P15428 1/20 0.46
CYP1A2 P05177 2/20 0.44
KDM4E B2RXH2 3/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
NOTUM Q6P988 2/20 0.42
MGAM O43451 1/20 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
SCHEMBL16032766 0.82 HDAC1 (0.48) SMN1; SMN2MAPTNPC1RAB9AALDH1A1
SCHEMBL29065959 0.82 XDH (0.48) MAPTALDH1A1KDM4EHDAC3HDAC4
SCHEMBL1314645 0.82 PTPN11 (0.43) SMN1; SMN2MAPTNPC1RAB9AALDH1A1
SCHEMBL9394 0.81 ALDH1A1 (0.50) SMN1; SMN2MAPTNPC1RAB9APPARG
SCHEMBL29183399 0.81 ALDH1A1 (0.39) SMN1; SMN2MAPTALDH1A1KDM4EKMT2A
SCHEMBL23146389 0.80 CDC7 (0.45) MAPTALDH1A1HPGDKDM4EHDAC3
SCHEMBL1849553 0.78 GAA (0.45) SMN1; SMN2MAPTNPC1RAB9AALDH1A1
SCHEMBL12151093 0.78 NPC1 (0.40) SMN1; SMN2MAPTNPC1RAB9AALDH1A1
SCHEMBL23146302 0.78 KDM4E (0.45) SMN1; SMN2MAPTNPC1RAB9ANFKB1
SCHEMBL8336785 0.78 KMO (0.37) MAPTNPC1RAB9AALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117285524-A Substituted 4-amino isoindoline compounds, preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2023-12-26 CN disclosed
WO-2019104011-A1 CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2019-05-31 WO disclosed
CN-102471311-B The ring diketone or derivatives thereof of the heteroaryl replacement of weeding activity SYNGENTA LTD. (GB) 2016-04-27 CN disclosed
EP-2459547-B1 HERBICIDALLY ACTIVE HETEROARYL-SUBSTITUTED CYCLIC DIONES OR DERIVATIVES THEREOF SYNGENTA LTD (GB) 2016-04-20 EP disclosed
EP-2459547-B1 HERBICIDALLY ACTIVE HETEROARYL-SUBSTITUTED CYCLIC DIONES OR DERIVATIVES THEREOF SYNGENTA LTD (GB) 2016-04-20 EP disclosed
CN-102459202-B As the inhibitor isoxazoline of fatty acid amide hydrolase INFINITY PHARMACEUTICALS, INC. (US) 2015-11-25 CN disclosed
US-9051300-B2 Herbicides SYNGENTA LIMITED (GB) 2015-06-09 US disclosed
US-9051300-B2 Herbicides SYNGENTA LIMITED (GB) 2015-06-09 US disclosed
US-9051300-B2 Herbicides SYNGENTA LIMITED (GB) 2015-06-09 US disclosed
EP-2375899-B1 PIPERIDINE-CONTAINING COMPOUNDS AND USE THEREOF IN THE TREATMENT OF DIABETES ARRAY BIOPHARMA INC (US) 2015-02-25 EP disclosed
EP-2173727-A1 NOVEL HERBICIDES Syngenta Limited (GB) 2010-04-14 EP disclosed
WO-2009000533-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2008-12-31 WO disclosed
EP-1592421-A1 HETEROARYLALKANOIC ACIDS AS INTEGRIN RECEPTOR ANTAGONISTS Pharmacia Corporation (US) 2005-11-09 EP disclosed
EP-1572691-A1 PYRAZOLE COMPOUNDS AS INTEGRIN RECEPTOR ANTAGONISTS DERIVATIVES Pharmacia Corporation (US) 2005-09-14 EP disclosed
US-20050043344-A1 Heteroarylalkanoic acids as integrin receptor antagonists derivatives PHARMACIA CORPORATION 2005-02-24 US disclosed
US-20050004200-A1 Pyrazole compounds as integrin receptor antagonists derivatives PHARMACIA CORPORATION 2005-01-06 US disclosed
WO-2004058761-A1 PYRAZOLE COMPOUNDS AS INTEGRIN RECEPTOR ANTAGONISTS DERIVATIVES PHARMACIA CORPORATION (US) 2004-07-15 WO disclosed
WO-2004058761-A1 PYRAZOLE COMPOUNDS AS INTEGRIN RECEPTOR ANTAGONISTS DERIVATIVES PHARMACIA CORPORATION (US) 2004-07-15 WO disclosed
WO-2004058254-A1 HETEROARYLALKANOIC ACIDS AS INTEGRIN RECEPTOR ANTAGONISTS PHARMACIA CORPORATION (US) 2004-07-15 WO disclosed
WO-2004058254-A1 HETEROARYLALKANOIC ACIDS AS INTEGRIN RECEPTOR ANTAGONISTS PHARMACIA CORPORATION (US) 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 (2 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-20050043344-A1 Heteroarylalkanoic acids as integrin receptor antagonists derivatives ITGA5, ITGAV, ITGA6 SMN1; SMN2 4308/4885MAPT 4206/4885NPC1 983/4885
US-20050004200-A1 Pyrazole compounds as integrin receptor antagonists derivatives ITGA5, ITGB3, ITGB5 SMN1; SMN2 4365/4885MAPT 3391/4885NPC1 2030/4885

“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.