SCHEMBL13638629

SCHEMBL13638629

Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(-n3c(=O)[nH]c4cc(NCCN5CCCC5)ccc4c3=O)cc2)s1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.55
HTR3A P46098 7/20 0.49
TERT O14746 3/20 0.38
CACNA1G O43497 2/20 0.38
HRH3 Q9Y5N1 3/20 0.38
GAA P10253 3/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 2/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL14113769 0.93 P2RY12 (0.53) P2RY12HTR3ATERTGAAKMT2A
SCHEMBL9922461 0.92 P2RY12 (0.64) P2RY12HTR3ATERTCACNA1G
SCHEMBL9922508 0.91 P2RY12 (0.63) P2RY12HTR3ATERTCACNA1GGAA
SCHEMBL9922853 0.90 P2RY12 (0.50) P2RY12HTR3ATERTCACNA1GHRH3
SCHEMBL14113575 0.90 P2RY12 (0.51) P2RY12HTR3ATERTGAAKMT2A
SCHEMBL12177238 0.90 P2RY12 (0.49) P2RY12HTR3ATERTCACNA1GHRH3
SCHEMBL14228343 0.90 P2RY12 (0.46) P2RY12HTR3ATERTCACNA1GHRH3
SCHEMBL9922665 0.88 P2RY12 (0.62) P2RY12HTR3ATERTCACNA1GHRH3
SCHEMBL12177205 0.88 P2RY12 (0.58) P2RY12HTR3AGAAKMT2AALDH1A1
SCHEMBL14113679 0.88 P2RY12 (0.56) P2RY12HTR3ATERTGAAKMT2A

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 89/4885HTR3A 2487/4885TERT 2357/4885

“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.