SCHEMBL9922804

SCHEMBL9922804

NS(=O)(=O)c1ccc2c(c1)C(=O)N(c1ccc(NC(=O)NS(=O)(=O)c3ccc(Cl)s3)cc1F)C(=O)C2

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.42
CA2 P00918 11/20 0.38
CA1 P00915 10/20 0.38
CA7 P43166 2/20 0.38
CA12 O43570 8/20 0.37
CA9 Q16790 8/20 0.37
KCNA1 Q09470 2/20 0.36
KCNAB1 Q14722 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
FBP1 P09467 1/20 0.35
GRM1 Q13255 1/20 0.34
MAPT P10636 2/20 0.34
KDR P35968 1/20 0.34
HTT P42858 1/20 0.34
APP P05067 1/20 0.34

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
SCHEMBL9922591 0.93 GRM1 (0.41) P2RY12CA2CA1CA7CA12
SCHEMBL9922277 0.92 P2RY12 (0.43) P2RY12KCNA1KCNAB1MEN1KMT2A
SCHEMBL9922801 0.91 P2RY12 (0.44) P2RY12KCNA1KCNAB1MEN1KMT2A
SCHEMBL9922802 0.90 P2RY12 (0.43) P2RY12KCNA1KCNAB1MEN1KMT2A
SCHEMBL9922799 0.89 P2RY12 (0.42) P2RY12KCNA1KCNAB1MEN1KMT2A
SCHEMBL9922073 0.88 P2RY12 (0.42) P2RY12CA2CA1CA7CA12
SCHEMBL9923094 0.88 CASP6 (0.46) P2RY12MEN1KMT2AFBP1GRM1
SCHEMBL9922273 0.88 APP (0.43) P2RY12KCNA1KCNAB1FBP1GRM1
SCHEMBL9922803 0.87 P2RY12 (0.43) P2RY12KCNA1KCNAB1MEN1KMT2A
SCHEMBL9922276 0.87 KMT2A (0.44) P2RY12KCNA1KCNAB1MEN1KMT2A

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 7 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-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-8067428-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-29 US disclosed
US-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2010-09-16 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
US-7358257-B2 sulfonylurea derivatives, sulfonylthiourea derivatives, sulfonylguanidine derivatives, sulfonylcyanoguanidine derivatives, thioacylsulfonamide derivatives, and acylsulfonamide derivatives; effective for prevention and treatment of cardiovascular diseases, antithrombotic agents PORTOLA PHARMACEUTICALS, INC. (US) 2008-04-15 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 (3 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-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 P2RY12 19/4885CA2 2120/4885CA1 4531/4885
US-20080194597-A1 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PIGS, GP6, ASGR1 P2RY12 89/4885CA2 2359/4885CA1 4578/4885
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 P2RY12 18/4885CA2 2119/4885CA1 4517/4885

“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.