SCHEMBL13638516

SCHEMBL13638516

CNc1ccc2c(=O)n(-c3ncc(NC(=O)NCc4ccc(C)s4)cc3F)c(=O)[nH]c2c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.38
ERCC1 P07992 1/20 0.35
FEN1 P39748 1/20 0.35
ERCC4 Q92889 1/20 0.35
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
MAPT P10636 3/20 0.34
RXFP1 Q9HBX9 3/20 0.34
TP53 P04637 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.33
HTR3A P46098 2/20 0.33
IDO1 P14902 1/20 0.33
HSP90AA1 P07900 1/20 0.32
METAP2 P50579 1/20 0.32
MAPK1 P28482 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL9923012 0.92 P2RY12 (0.45) P2RY12ERCC1FEN1ERCC4CA12
SCHEMBL14228582 0.88 RXFP1 (0.38) P2RY12ERCC1FEN1ERCC4CA12
SCHEMBL13182836 0.88 P2RY12 (0.40) P2RY12ERCC1FEN1ERCC4CA12
SCHEMBL12177433 0.87 P2RY12 (0.41) P2RY12ERCC1FEN1ERCC4CA12
SCHEMBL12177356 0.84 P2RY12 (0.54) P2RY12ERCC1FEN1ERCC4CA12
SCHEMBL12177256 0.83 ERCC1 (0.36) P2RY12ERCC1FEN1ERCC4CA12
SCHEMBL12177436 0.81 ERCC1 (0.40) P2RY12ERCC1FEN1ERCC4CA12
SCHEMBL12177309 0.81 P2RY12 (0.38) P2RY12ERCC1FEN1ERCC4CA12
SCHEMBL13638521 0.81 ERCC1 (0.35) P2RY12ERCC1FEN1ERCC4CA12
SCHEMBL13638376 0.80 AR (0.40) P2RY12ERCC1FEN1ERCC4CA12

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-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 P2RY12 89/4885ERCC1 3801/4885FEN1 3974/4885

“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.