SCHEMBL13633643

SCHEMBL13633643

O=C(Nc1ccc(C2C(=O)c3ccccc3NC2O)c(F)c1)NS(=O)(=O)c1ccc(Cl)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.42
FBP1 P09467 1/20 0.38
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
LMNA P02545 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
MAPT P10636 4/20 0.36
HTT P42858 3/20 0.35
RECQL P46063 2/20 0.35
PGAM1 P18669 1/20 0.35
KDR P35968 2/20 0.35
ALDH1A1 P00352 2/20 0.34
POLB P06746 1/20 0.34
PSEN1 P49768 4/20 0.34
PSEN2 P49810 4/20 0.34
APH1B Q8WW43 4/20 0.34
NCSTN Q92542 4/20 0.34
APH1A Q96BI3 4/20 0.34
PSENEN Q9NZ42 4/20 0.34
APP P05067 3/20 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
SCHEMBL9922651 0.85 P2RY12 (0.42) P2RY12FBP1MEN1KMT2ALMNA
SCHEMBL14200788 0.77 CYP19A1 (0.46) P2RY12FBP1MEN1KMT2ALMNA
SCHEMBL9923034 0.76 P2RY12 (0.46) P2RY12FBP1MEN1KMT2ALMNA
SCHEMBL13633800 0.76 KDR (0.38) P2RY12FBP1MEN1KMT2ALMNA
SCHEMBL9922561 0.75 P2RY12 (0.44) P2RY12FBP1MEN1KMT2ALMNA
SCHEMBL1548736 0.75 P2RY12 (0.49) P2RY12FBP1MEN1KMT2ALMNA
SCHEMBL9922956 0.73 MEN1 (0.41) P2RY12FBP1MEN1KMT2ALMNA
SCHEMBL9922556 0.73 P2RY12 (0.43) P2RY12FBP1MEN1KMT2ALMNA
SCHEMBL12706443 0.72 P2RY12 (0.51) P2RY12FBP1MEN1KMT2ALMNA
SCHEMBL9922563 0.71 P2RY12 (0.49) P2RY12FBP1MEN1KMT2ALMNA

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-7622474-B2 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-24 US disclosed