SCHEMBL13638630

SCHEMBL13638630

Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(-n3c(=O)[nH]c4cc(NC5CC5)ccc4c3=O)cc2)s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.56
KMT2A Q03164 3/20 0.38
GAA P10253 3/20 0.38
TP53 P04637 2/20 0.36
MAPT P10636 1/20 0.36
LMNA P02545 4/20 0.36
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ERCC1 P07992 1/20 0.36
FEN1 P39748 1/20 0.36
ERCC4 Q92889 1/20 0.36
RXFP1 Q9HBX9 3/20 0.35
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 1/20 0.34
GLA P06280 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
SCHEMBL9922558 0.91 P2RY12 (0.66) P2RY12KMT2AGAATP53MAPT
SCHEMBL9923019 0.89 P2RY12 (0.65) P2RY12KMT2AGAATP53MAPT
SCHEMBL12177227 0.88 P2RY12 (0.51) P2RY12KMT2AGAAMAPTALDH1A1
SCHEMBL12177205 0.86 P2RY12 (0.58) P2RY12KMT2AGAATP53MAPT
SCHEMBL12177232 0.83 P2RY12 (0.43) P2RY12TP53MAPTLMNAPPARG
SCHEMBL13638629 0.83 P2RY12 (0.55) P2RY12KMT2AGAATP53MAPT
SCHEMBL14113679 0.83 P2RY12 (0.56) P2RY12KMT2AGAATP53MAPT
SCHEMBL12177250 0.83 P2RY12 (0.58) P2RY12KMT2AGAATP53MAPT
SCHEMBL14113574 0.82 P2RY12 (0.59) P2RY12KMT2AGAATP53MAPT
SCHEMBL14113769 0.81 P2RY12 (0.53) P2RY12KMT2AGAALMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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