SCHEMBL5363909

SCHEMBL5363909

Cc1ccc(-c2cc(C#N)c(N3CCN(C)CC3)nc2-c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 18/20 0.74
CNR2 P34972 17/20 0.74
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
TP53 P04637 1/20 0.51

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
SCHEMBL5361329 0.93 CNR1 (0.85) CNR1CNR2
SCHEMBL5359517 0.92 CNR1 (0.88) CNR1CNR2
SCHEMBL5360588 0.80 CNR1 (0.61) CNR1CNR2
SCHEMBL3613257 0.76 CNR1 (0.65) CNR1CNR2
SCHEMBL5354553 0.74 CNR1 (0.65) CNR1CNR2
SCHEMBL3626666 0.72 CNR1 (0.69) CNR1CNR2
SCHEMBL5371173 0.72 CNR1 (0.56) CNR1CNR2
SCHEMBL5371374 0.72 CNR1 (1.00) CNR1CNR2
SCHEMBL5364649 0.72 CNR1 (0.67) CNR1CNR2
SCHEMBL5358712 0.71 CNR1 (0.69) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7271266-B2 Substituted 2,3-diphenyl pyridines MERCK & CO., INC. (US) 2007-09-18 US disclosed
US-7271266-B2 Substituted 2,3-diphenyl pyridines MERCK & CO., INC. (US) 2007-09-18 US disclosed
US-7271266-B2 Substituted 2,3-diphenyl pyridines MERCK & CO., INC. (US) 2007-09-18 US disclosed
US-20050182103-A1 Substituted 2,3-diphenyl pyridines MERCK SHARP & DOHME CORP. 2005-08-18 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-20050182103-A1 Substituted 2,3-diphenyl pyridines CNR1, CNR2, MAG CNR1 1/4885CNR2 2/4885KDM4E 1804/4885

“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.