SCHEMBL12177635

SCHEMBL12177635

Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(-n3c(=O)[nH]c4cc(NCC5CC5)ccc4c3=O)c(Cl)c2)s1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.48
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
ERCC1 P07992 1/20 0.34
FEN1 P39748 1/20 0.34
ERCC4 Q92889 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.34
GCK P35557 3/20 0.34
NPY2R P49146 5/20 0.33
MAPT P10636 3/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA9 Q16790 2/20 0.33
TP53 P04637 2/20 0.33
NPY5R Q15761 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL9923147 0.93 P2RY12 (0.54) P2RY12ERCC1FEN1ERCC4KDM4E
SCHEMBL14113677 0.93 P2RY12 (0.44) P2RY12BRD4CREBBPERCC1FEN1
SCHEMBL12177237 0.91 P2RY12 (0.49) P2RY12BRD4CREBBPERCC1FEN1
SCHEMBL14113683 0.89 P2RY12 (0.51) P2RY12BRD4CREBBPERCC1FEN1
SCHEMBL9922505 0.86 P2RY12 (0.58) P2RY12ERCC1FEN1ERCC4GCK
SCHEMBL13638702 0.84 P2RY12 (0.38) P2RY12ERCC1FEN1ERCC4KDM4E
SCHEMBL9922877 0.84 P2RY12 (0.58) P2RY12ERCC1FEN1ERCC4KDM4E
SCHEMBL9922645 0.83 P2RY12 (0.64) P2RY12GCKMAPTTP53KMT2A
SCHEMBL9923149 0.83 P2RY12 (0.59) P2RY12ERCC1FEN1ERCC4KDM4E
SCHEMBL9922879 0.82 P2RY12 (0.56) P2RY12ERCC1FEN1ERCC4KDM4E

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-8067428-B2 Platelet ADP receptor inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2011-11-29 US disclosed
US-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2010-09-16 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-20100234350-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 P2RY12 19/4885BRD4 3071/4885CREBBP 3070/4885

“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.