SCHEMBL9923253

SCHEMBL9923253

COc1ccc2[nH]cc(-c3ccc(NC(=O)NS(=O)(=O)c4ccc(C)s4)cc3F)c(=O)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 3/20 0.39
HTT P42858 1/20 0.39
TP53 P04637 2/20 0.39
KIT P10721 1/20 0.38
KDM4E B2RXH2 3/20 0.38
NLRP3 Q96P20 2/20 0.37
ALDH1A1 P00352 2/20 0.37
GALR3 O60755 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
PDE4B Q07343 1/20 0.36
FBP1 P09467 1/20 0.36
PRKAB2 O43741 1/20 0.36
PRKAG1 P54619 1/20 0.36
PRKAA2 P54646 1/20 0.36
PRKAA1 Q13131 1/20 0.36
PRKAG3 Q9UGI9 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
SCHEMBL12161715 0.91 MEN1 (0.46) MAPTSMN1; SMN2LMNAHTTTP53
SCHEMBL9922220 0.90 MAPT (0.40) MAPTSMN1; SMN2LMNAHTTTP53
SCHEMBL9922908 0.88 DHODH (0.42) MAPTSMN1; SMN2LMNAHTTTP53
SCHEMBL9923257 0.85 HTR2C (0.43) MAPTSMN1; SMN2LMNAHTTTP53
SCHEMBL12161710 0.83 MEN1 (0.47) MAPTSMN1; SMN2LMNAHTTTP53
SCHEMBL14113780 0.82 MEN1 (0.46) MAPTSMN1; SMN2LMNAHTTTP53
SCHEMBL9923260 0.82 KIT (0.43) MAPTKITNLRP3MEN1KMT2A
SCHEMBL12161691 0.79 MEN1 (0.49) MAPTSMN1; SMN2LMNAHTTTP53
SCHEMBL12177423 0.77 STING1 (0.46) MAPTLMNAP2RY12
SCHEMBL9922655 0.77 P2RY12 (0.47) MAPTSMN1; SMN2LMNAHTTMEN1

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-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
US-7622474-B2 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-24 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-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 MAPT 4832/4885SMN1; SMN2 3093/4885LMNA 3603/4885

“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.