SCHEMBL9922444

SCHEMBL9922444

Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc(N3C(=O)c4cc5c(cc4C(N)C3=O)NCC5)cc2)s1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
P2RY12 Q9H244 1/20 0.34
NLRP3 Q96P20 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
USP2 O75604 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL9922425 0.84 BRD4 (0.37) BRD4CREBBPP2RY12NLRP3MEN1
SCHEMBL9923016 0.81 P2RY12 (0.42) P2RY12
SCHEMBL12160790 0.75 P2RY12 (0.43) P2RY12MEN1KMT2ALMNAHTT
SCHEMBL9922839 0.73 P2RY12 (0.35) P2RY12NLRP3MEN1KMT2A
SCHEMBL9923018 0.72 P2RY12 (0.43) P2RY12MEN1KMT2AUSP2LMNA
SCHEMBL9922448 0.72 P2RY12 (0.37) BRD4CREBBPP2RY12MEN1KMT2A
SCHEMBL13638361 0.72 KMT2A (0.50) BRD4CREBBPMEN1KMT2AUSP2
SCHEMBL12161524 0.71 PTGER3 (0.37) P2RY12
SCHEMBL14113565 0.71 GAA (0.38) BRD4CREBBPP2RY12NLRP3MEN1
SCHEMBL9922271 0.69 P2RY12 (0.38) BRD4CREBBPP2RY12NLRP3

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 BRD4 3064/4885CREBBP 3041/4885P2RY12 18/4885

“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.