SCHEMBL9922271

SCHEMBL9922271

Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(-n3ccc4c5c(ccc4c3=O)NCC5)cc2)s1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.38
NAMPT P43490 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
NLRP3 Q96P20 1/20 0.31
PPARG P37231 1/20 0.31

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
SCHEMBL12161166 0.91 P2RY12 (0.45) P2RY12
SCHEMBL12177197 0.87 P2RY12 (0.38) P2RY12BRD4CREBBPNLRP3
SCHEMBL9922445 0.82 P2RY12 (0.48) P2RY12NAMPTBRD4CREBBPNLRP3
SCHEMBL9923168 0.80
SCHEMBL9922929 0.80 P2RY12 (0.42) P2RY12
SCHEMBL9922921 0.80 FBP1 (0.41) P2RY12
SCHEMBL9923129 0.79 P2RY12 (0.46) P2RY12
SCHEMBL13638631 0.78 P2RY12 (0.32) P2RY12NAMPTBRD4CREBBPNLRP3
SCHEMBL9922553 0.77 P2RY12 (0.44) P2RY12
SCHEMBL12177097 0.76 P2RY12 (0.37) P2RY12BRD4CREBBPNLRP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 (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-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 P2RY12 19/4885NAMPT 1845/4885BRD4 3071/4885
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 P2RY12 18/4885NAMPT 1832/4885BRD4 3064/4885

“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.