SCHEMBL2472149

SCHEMBL2472149

Cc1onc(-c2cccc(F)c2)c1-c1cn(-c2cccc(C(=O)O)c2)cn1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 3/20 0.46
GPBAR1 Q8TDU6 1/20 0.42
GABRA5 P31644 12/20 0.41
KDM5A P29375 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
MAPK14 Q16539 1/20 0.38

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
SCHEMBL2477300 0.91 GABRA5 (0.43) KDM4CGPBAR1GABRA5KDM5AKDM5B
SCHEMBL2472123 0.91 MAPK14 (0.45) KDM4EALDH1A1PKMPTGS1PTGS2
SCHEMBL2473240 0.88 GABRA5 (0.53) GABRA5MAPK14
SCHEMBL2471693 0.86 GABRA5 (0.50) GABRA5
SCHEMBL2471420 0.86 GABRA5 (0.50) GABRA5
SCHEMBL2476849 0.86 PTGS2 (0.48) PTGS1PTGS2MAPK14
SCHEMBL2470769 0.85 GABRA5 (0.43) GPBAR1GABRA5PTGS1PTGS2MAPK14
SCHEMBL2472558 0.85 GABRA5 (0.56) GABRA5
SCHEMBL2471840 0.84 GABRA5 (0.56) GABRA5
SCHEMBL2475959 0.82 GABRA5 (0.45) GABRA5KDM4EALDH1A1PTGS1PTGS2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1968973-B1 ARYL-ISOXAZOL-4-YL-IMIDAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-10-05 EP disclosed
US-7414061-B2 Aryl-isoxazol-4-yl-imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-08-19 US disclosed
US-20070161654-A1 Aryl-isoxazol-4-yl-imidazole derivatives HOFFMANN-LA ROCHE INC. 2007-07-12 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-20070161654-A1 Aryl-isoxazol-4-yl-imidazole derivatives GABRA5, GABRA4, GABRA1 KDM4C 1096/4885GPBAR1 184/4885GABRA5 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.