SCHEMBL13638486

SCHEMBL13638486

Cn1c(=O)[nH]c2ccc(S(C)(=O)=O)cc2c1=O

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 8/20 0.62
ADORA3 P0DMS8 2/20 0.54
ADORA2B P29275 2/20 0.54
ADORA2A P29274 1/20 0.54
ADORA1 P30542 1/20 0.54
BRD4 O60885 1/20 0.47
MAPT P10636 1/20 0.42
CDK1 P06493 1/20 0.40
CCNA2 P20248 1/20 0.40
CDK2 P24941 1/20 0.40
PIK3CG P48736 1/20 0.40
CA12 O43570 3/20 0.39
CA9 Q16790 3/20 0.39
FEN1 P39748 1/20 0.39

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
SCHEMBL6390624 0.86 PARG (0.61) PARGADORA3ADORA2BADORA2AADORA1
SCHEMBL17824637 0.86 PARG (0.61) PARGADORA3ADORA2BADORA2AADORA1
Hydrochloric Acid SCHEMBL28174304 0.85 PARG (0.60) PARGADORA3ADORA2BADORA2AADORA1
SCHEMBL17825151 0.77 PARG (1.00) PARG
SCHEMBL8215674 0.77 ADORA3 (0.61) PARGADORA3ADORA2BADORA2AADORA1
SCHEMBL5355203 0.76 CA12 (0.66) PARGADORA3ADORA2BADORA2AADORA1
SCHEMBL9919007 0.76 CA9 (0.66) PARGADORA3ADORA2BADORA2AADORA1
SCHEMBL9919006 0.76 FEN1 (0.66) PARGADORA3ADORA2BADORA2AADORA1
SCHEMBL9923029 0.76 ADORA3 (0.59) PARGADORA3ADORA2BADORA2AADORA1
SCHEMBL5712368 0.76 ADORA3 (0.59) PARGADORA3ADORA2BADORA2AADORA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524721-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2013-09-03 US disclosed
US-7622474-B2 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-24 US disclosed
US-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2008-08-14 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 (1 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-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PIGS, GP6, ASGR1 PARG 3527/4885ADORA3 32/4885ADORA2B 21/4885

“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.