SCHEMBL11909692

SCHEMBL11909692

COC(=O)c1ccc2nc(-c3ccc(-c4ccc(OC)cc4)cc3)n(C[C@@H]3CCN(C(=O)C4CC4)C3)c2c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.45
BRD4 O60885 9/20 0.45
FASN P49327 3/20 0.44
MC4R P32245 2/20 0.43
MAPK10 P53779 1/20 0.43
P2RX3 P56373 2/20 0.42
BRD2 P25440 1/20 0.42
EP300 Q09472 1/20 0.42
BRD3 Q15059 1/20 0.42
BRDT Q58F21 1/20 0.42

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
SCHEMBL11909694 1.00 PTGER4 (0.45) PTGER4BRD4FASNMC4RMAPK10
SCHEMBL10219 0.92 PTGER4 (0.51) PTGER4BRD4FASNMC4RBRD2
SCHEMBL10218 0.92 PTGER4 (0.51) PTGER4BRD4FASNMC4RBRD2
SCHEMBL10484 0.92 PTGER4 (0.49) PTGER4BRD4FASNBRD2EP300
SCHEMBL10485 0.92 PTGER4 (0.49) PTGER4BRD4FASNBRD2EP300
SCHEMBL11908763 0.92 BRD4 (0.50) PTGER4BRD4FASNMC4RMAPK10
SCHEMBL13727 0.92 BRD4 (0.50) PTGER4BRD4FASNMC4RMAPK10
SCHEMBL22220766 0.92 BRD4 (0.50) PTGER4BRD4FASNMC4RMAPK10
SCHEMBL13599 0.92 FASN (0.46) PTGER4BRD4FASNMC4RBRD2
SCHEMBL13600 0.92 FASN (0.46) PTGER4BRD4FASNMC4RBRD2

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-20120208827-A1 BENZIMIDAZOLES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC 2012-08-16 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-20120208827-A1 BENZIMIDAZOLES AS FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 PTGER4 2567/4885BRD4 277/4885FASN 1/4885

“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.