SCHEMBL14518342

SCHEMBL14518342

Cc1cc(C)c2c(c1)n(CC(=O)Nc1ccc3c(c1)CC1(C3)C(=O)NC(=O)N1C)c(=O)n2CC(N)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 20/20 1.00

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
SCHEMBL14518344 0.93 CALCRL (1.00) CALCRL
SCHEMBL14518337 0.91 CALCRL (1.00) CALCRL
SCHEMBL14518345 0.90 CALCRL (1.00) CALCRL
SCHEMBL14518336 0.90 CALCRL (1.00) CALCRL
SCHEMBL12362509 0.85 CALCRL (0.74) CALCRL
SCHEMBL12431326 0.81 CALCRL (1.00) CALCRL
SCHEMBL12430760 0.81 CALCRL (1.00) CALCRL
SCHEMBL14518369 0.81 CALCRL (1.00) CALCRL
SCHEMBL12362507 0.77 CALCRL (0.74) CALCRL
SCHEMBL12431321 0.76 CALCRL (0.76) CALCRL

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-7202251-B2 Bicyclic anilide spirohydantoin CGRP receptor antagonists MERCK & CO., INC. (US) 2007-04-10 — — US disclosed
US-7202251-B2 Bicyclic anilide spirohydantoin CGRP receptor antagonists MERCK & CO., INC. (US) 2007-04-10 — — US disclosed
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