SCHEMBL3145582

SCHEMBL3145582

Cc1c(Cl)cccc1N(C)C(=O)c1cc(NC(=O)c2ccccc2C(F)(F)F)cc(-c2nc3cc(C(C)(C)C)ccc3o2)c1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGES O14684 9/20 0.52
MAPT P10636 5/20 0.45
TP53 P04637 5/20 0.44
PPARG P37231 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
PTGS2 P35354 1/20 0.42
SMN1; SMN2 Q16637 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
SCHEMBL3138271 0.81 RAB9A (0.43) MAPTTP53RXFP1SMN1; SMN2
SCHEMBL3138804 0.78 PPARG (0.43) MAPTTP53PPARGPTGS2SMN1; SMN2
SCHEMBL3138634 0.78 PTGES (0.52) PTGESMAPTTP53PPARGRXFP1
SCHEMBL4498498 0.78 PTGES (0.81) PTGESMAPTTP53PPARGSMN1; SMN2
SCHEMBL3136360 0.76 PTGES (0.49) PTGESMAPTPPARGRXFP1
SCHEMBL4518282 0.69 PTGES (1.00) PTGESMAPTTP53
SCHEMBL3137146 0.68 PTGES (0.58) PTGESMAPTTP53PPARGRXFP1
SCHEMBL4505504 0.68 PTGES (0.78) PTGESMAPTTP53SMN1; SMN2
SCHEMBL14712927 0.68 PTGES (0.77) PTGES
SCHEMBL4506643 0.68 PTGES (0.83) PTGESMAPTTP53SMN1; SMN2

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 162/4885MAPT 270/4885TP53 2523/4885

“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.