SCHEMBL2120127

SCHEMBL2120127

CC(NC(=O)c1onc(-c2ccc(F)cc2)c1Cl)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.52
GABRA5 P31644 8/20 0.46
GRIN2B Q13224 1/20 0.40
LMNA P02545 1/20 0.40
GABRA1 P14867 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL2120123 1.00 TRPV1 (0.52) TRPV1GABRA5GRIN2BLMNAGABRA1
SCHEMBL10039159 0.91 GABRA5 (0.48) TRPV1GABRA5GABRA1SMN1; SMN2
SCHEMBL2117707 0.89 TRPV1 (0.56) TRPV1GABRA5
SCHEMBL2117703 0.89 TRPV1 (0.56) TRPV1GABRA5
SCHEMBL2118396 0.78 TRPV1 (0.57) TRPV1
SCHEMBL2118393 0.78 TRPV1 (0.57) TRPV1
SCHEMBL10039170 0.76 GABRA5 (0.43) GABRA5GABRA1SMN1; SMN2ALDH1A1
SCHEMBL2117773 0.76 TRPV1 (0.55) TRPV1GABRA5LMNAL3MBTL1
SCHEMBL2117862 0.75 TRPV1 (0.44) TRPV1GABRA5GABRA1
SCHEMBL2117857 0.75 TRPV1 (0.44) TRPV1GABRA5GABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120095002-A1 ISOXAZOLE-5-CARBOXAMIDE DERIVATIVES N.V. ORGANON (NL) 2012-04-19 US claimed
US-20120095002-A1 ISOXAZOLE-5-CARBOXAMIDE DERIVATIVES N.V. ORGANON (NL) 2012-04-19 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-20120095002-A1 ISOXAZOLE-5-CARBOXAMIDE DERIVATIVES TRPV1, TRPV5, P2RX5 TRPV1 1/4885GABRA5 47/4885GRIN2B 326/4885

“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.