SCHEMBL9922778

SCHEMBL9922778

Cc1cc(S(=O)(=O)NC(=O)Nc2ccc(-n3ccc4cc5ncoc5cc4c3=O)cc2)sc1Cl

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.37
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CA12 O43570 6/20 0.34
CA9 Q16790 6/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 2/20 0.34
FBP1 P09467 9/20 0.33
PPARG P37231 1/20 0.32
PTGER3 P43115 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
SCHEMBL12161548 0.92 P2RY12 (0.36) P2RY12NPC1RAB9ASMN1; SMN2CA12
SCHEMBL12177672 0.91 P2RY12 (0.37) P2RY12NPC1RAB9ASMN1; SMN2CA12
SCHEMBL9922796 0.88 P2RY12 (0.44) P2RY12NPC1RAB9ASMN1; SMN2FBP1
SCHEMBL14228331 0.88 P2RY12 (0.36) P2RY12NPC1RAB9ASMN1; SMN2CA12
SCHEMBL9922312 0.79 FBP1 (0.41) P2RY12NPC1RAB9ASMN1; SMN2CA12
SCHEMBL9922816 0.79 P2RY12 (0.40) P2RY12NPC1RAB9ASMN1; SMN2CA12
SCHEMBL9922600 0.77 IKBKB (0.41) P2RY12NPC1RAB9AFBP1PTGER3
SCHEMBL9922602 0.77 P2RY12 (0.39) P2RY12FBP1PTGER3
SCHEMBL9922874 0.75 P2RY12 (0.34) P2RY12NPC1RAB9ASMN1; SMN2CA12
SCHEMBL9922599 0.75 P2RY12 (0.39) P2RY12FBP1PTGER3

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 18/4885NPC1 3099/4885RAB9A 425/4885

“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.