SCHEMBL9922839

SCHEMBL9922839

Cc1cc(S(=O)(=O)NC(=O)Nc2ccc(N3C(=O)Cc4cc5c(cc4C3=O)CCN5)cc2)sc1Cl

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.35
PTGER3 P43115 4/20 0.35
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FBP1 P09467 7/20 0.32
GRM1 Q13255 1/20 0.32
KCNA1 Q09470 5/20 0.31
KCNAB1 Q14722 5/20 0.31
NLRP3 Q96P20 1/20 0.30

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
SCHEMBL12161524 0.92 PTGER3 (0.37) P2RY12PTGER3KCNA1KCNAB1
SCHEMBL12160790 0.88 P2RY12 (0.43) P2RY12PTGER3MEN1KMT2ASMN1; SMN2
SCHEMBL9922425 0.88 BRD4 (0.37) P2RY12MEN1GAAKMT2ASMN1; SMN2
SCHEMBL17715368 0.85 GAA (0.37) P2RY12PTGER3MEN1GAAKMT2A
SCHEMBL9922197 0.79 PTGER3 (0.44) P2RY12PTGER3KCNA1KCNAB1
SCHEMBL9923238 0.79 PTGER3 (0.35) P2RY12PTGER3MEN1KMT2AFBP1
SCHEMBL9922482 0.79 P2RY12 (0.39) P2RY12MEN1KMT2ASMN1; SMN2FBP1
SCHEMBL9922481 0.78 FBP1 (0.40) P2RY12MEN1KMT2AFBP1
SCHEMBL9922376 0.78 P2RY12 (0.42) P2RY12PTGER3MEN1GAAKMT2A
SCHEMBL9922375 0.77 PTGER3 (0.40) P2RY12PTGER3MEN1GAAKMT2A

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 1 patent. 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

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 P2RY12 18/4885PTGER3 97/4885MEN1 4499/4885

“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.