SCHEMBL14394085

SCHEMBL14394085

Cc1ccc(-c2c(C#N)c(C(N)=O)c3n2CCN(C(=O)Nc2ccc(C(F)(F)F)cc2)C3)cn1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 7/20 0.48
▸ TRPV1 Q8NER1 9/20 0.43
▸ KIT P10721 1/20 0.39
▸ CSNK1D P48730 1/20 0.39
▸ PAK1 Q13153 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39

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
SCHEMBL14393989 0.88 TRPV1 (0.51) CSNK1ETRPV1CSNK1D
SCHEMBL14394075 0.87 CSNK1E (0.47) CSNK1ETRPV1CSNK1D
SCHEMBL14394076 0.84 CSNK1E (0.46) CSNK1ETRPV1
SCHEMBL13964146 0.81 CSNK1E (0.47) CSNK1ECSNK1D
SCHEMBL13964286 0.80 TRPV1 (0.47) CSNK1ETRPV1CSNK1D
SCHEMBL13964284 0.79 KIT (0.51) CSNK1ETRPV1KITCSNK1D
SCHEMBL14368516 0.79 CSNK1E (0.57) CSNK1ETRPV1CSNK1D
SCHEMBL14393984 0.79 CSNK1E (0.58) CSNK1ECSNK1D
SCHEMBL13964287 0.78 CSNK1E (0.52) CSNK1ECSNK1D
SCHEMBL13964142 0.77 CSNK1E (0.47) CSNK1ECSNK1D

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-20070238734-A1 JNK INHIBITORS SANOLI-AVENTIS (FR) 2007-10-11 — — 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-20070238734-A1 JNK INHIBITORS MAP3K7, MAPKAPK2, MAPK7 CSNK1E 136/4885TRPV1 4093/4885KIT 1838/4885

“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.

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