SCHEMBL10207148

SCHEMBL10207148

Cc1ccc2c(n1)CC1(C2)C(=O)Nc2ncccc21

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CALCA P06881 3/20 0.46
CALCRL Q16602 16/20 0.43
RAMP1 O60894 7/20 0.42
ADM2 Q7Z4H4 1/20 0.40

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
SCHEMBL16658950 0.85 CALCRL (0.48) CALCACALCRLRAMP1
SCHEMBL29549672 0.85 CALCRL (0.48) CALCACALCRLRAMP1
SCHEMBL837966 0.85 CALCA (0.46) CALCACALCRLRAMP1ADM2
SCHEMBL845957 0.84 CALCA (0.44) CALCACALCRLRAMP1ADM2
SCHEMBL24962035 0.84 CALCRL (0.44) CALCACALCRLRAMP1
SCHEMBL1394658 0.83 CALCA (0.63) CALCACALCRL
SCHEMBL10189878 0.83 CALCA (0.63) CALCACALCRL
SCHEMBL1393888 0.83 CALCA (0.63) CALCACALCRL
SCHEMBL877307 0.82 CALCA (0.45) CALCACALCRLRAMP1
SCHEMBL837386 0.81 CALCRL (0.45) CALCACALCRLRAMP1ADM2

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-8173655-B2 Bicyclic anilide heterocyclic CGRP receptor antagonists Merck, Sharp & Dohme Corp. (US) 2012-05-08 US disclosed
US-20100093759-A1 BICYCLIC ANILIDE HETEROCYCLIC CGRP RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LLC 2010-04-15 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-20100093759-A1 BICYCLIC ANILIDE HETEROCYCLIC CGRP RECEPTOR ANTAGONISTS BDKRB1, BDKRB2, CCKBR CALCA 9/4885CALCRL 5/4885RAMP1 42/4885

“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.