SCHEMBL9922995

SCHEMBL9922995

CNc1ccc2c(=O)n(-c3c(F)cc(NC(=O)NS(=O)(=O)c4ccc(Cl)s4)cc3I)ccc2c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 3/20 0.48
FBP1 P09467 1/20 0.35
MAPT P10636 2/20 0.34
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
LMNA P02545 2/20 0.30
HTT P42858 2/20 0.30
RECQL P46063 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 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
SCHEMBL9922990 0.94 P2RY12 (0.51) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL12161667 0.92 P2RY12 (0.49) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL13633801 0.89 P2RY12 (0.47) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL9922992 0.89 P2RY12 (0.47) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL14228344 0.89 P2RY12 (0.47) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL9922112 0.87 P2RY12 (0.53) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL9923000 0.86 P2RY12 (0.47) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL13638632 0.86 P2RY12 (0.42) P2RY12MEN1KMT2A
SCHEMBL9922997 0.84 P2RY12 (0.48) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL9920086 0.84 P2RY12 (0.54) P2RY12FBP1MAPTMEN1KMT2A

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 4 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-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
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 (2 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 19/4885FBP1 1584/4885MAPT 4832/4885
US-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 P2RY12 18/4885FBP1 1579/4885MAPT 4832/4885

“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.