SCHEMBL14535474

SCHEMBL14535474

C[C@@H](NC(=O)c1nn(-c2ccc(Cl)cc2Cl)c(-c2cccs2)c1C#N)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 16/20 0.51
CNR2 P34972 11/20 0.51
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL14535303 1.00 CNR1 (0.51) CNR1CNR2MEN1KMT2A
SCHEMBL14535470 0.89 CNR1 (0.56) CNR1CNR2
SCHEMBL14535288 0.88 CNR1 (0.51) CNR1CNR2
SCHEMBL14535284 0.88 CNR1 (0.51) CNR1CNR2
SCHEMBL14510286 0.88 CNR2 (0.66) CNR1CNR2
SCHEMBL14510285 0.88 CNR2 (0.66) CNR1CNR2
SCHEMBL14535471 0.84 CNR1 (0.55) CNR1CNR2
SCHEMBL4968158 0.84 CNR1 (0.54) CNR1CNR2MEN1KMT2A
SCHEMBL14535302 0.80 CNR1 (0.77) CNR1CNR2
SCHEMBL14535287 0.78 CNR1 (0.63) CNR1CNR2

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-20070117858-A1 SUBSTITUTED 5-HETEROARYL-1-PHENYL-PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-05-24 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-20070117858-A1 SUBSTITUTED 5-HETEROARYL-1-PHENYL-PYRAZOLE CANNABINOID MODULATORS CNR1, CNR2, GPR18 CNR1 1/4885CNR2 2/4885MEN1 3497/4885

“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.