SCHEMBL3136360

SCHEMBL3136360

CC(C)(C)c1ccc2oc(-c3cc(COc4cccc(Cl)c4)cc(NC(=O)c4ccccc4C(F)(F)F)c3)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGES O14684 5/20 0.49
RXFP1 Q9HBX9 2/20 0.48
MAPT P10636 2/20 0.48
CETP P11597 6/20 0.48
P2RY14 Q15391 4/20 0.46
PPARG P37231 1/20 0.45

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
SCHEMBL3138634 0.88 PTGES (0.52) PTGESRXFP1MAPTCETPPPARG
SCHEMBL3128346 0.78 RAB9A (0.47) RXFP1MAPTCETPP2RY14
SCHEMBL3137146 0.77 PTGES (0.58) PTGESRXFP1MAPTCETPPPARG
SCHEMBL3133366 0.76 CETP (0.50) RXFP1MAPTCETPP2RY14PPARG
SCHEMBL4498498 0.76 PTGES (0.81) PTGESMAPTPPARG
SCHEMBL3145582 0.76 PTGES (0.52) PTGESRXFP1MAPTPPARG
SCHEMBL3131397 0.70 PTGES (0.56) PTGESRXFP1MAPTCETP
SCHEMBL3131388 0.70 PTGES (0.56) PTGESRXFP1MAPTCETP
SCHEMBL4506643 0.69 PTGES (0.83) PTGESMAPT
SCHEMBL4512212 0.69 TP53 (0.65) RXFP1MAPTP2RY14

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-20100004301-A1 Benzoxazoles Useful in the Treatment of Inflammation BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-01-07 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-20100004301-A1 Benzoxazoles Useful in the Treatment of Inflammation IL4I1, EPX, IL4 PTGES 162/4885RXFP1 717/4885MAPT 270/4885

“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.