SCHEMBL30231295

SCHEMBL30231295

COC(=O)C(C)NC(=O)N1CCC(N2Cc3ccccc3NC2=O)CC1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 18/20 0.58
▸ RAMP1 O60894 11/20 0.58
▸ CALCA P06881 1/20 0.56
▸ CHRM4 P08173 1/20 0.52
▸ CYP3A4 P08684 3/20 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
SCHEMBL13081133 0.80 CALCA (0.54) CALCRLRAMP1CALCACYP3A4
SCHEMBL3282021 0.80 CALCA (0.60) CALCRLCALCACYP3A4
SCHEMBL3595749 0.80 CALCA (0.58) CALCRLCALCACYP3A4
SCHEMBL3607821 0.79 CALCRL (0.76) CALCRLCALCACYP3A4
SCHEMBL3607815 0.79 CALCRL (0.76) CALCRLCALCACYP3A4
SCHEMBL3237433 0.79 CHRM4 (0.57) CALCRLRAMP1CALCACHRM4
SCHEMBL29872644 0.79 CALCRL (0.54) CALCRLRAMP1CALCACHRM4
SCHEMBL13762761 0.79 CALCRL (0.54) CALCRLRAMP1CALCACHRM4
SCHEMBL13080979 0.79 CALCRL (0.54) CALCRLCALCACYP3A4
SCHEMBL3591393 0.79 CALCA (0.57) CALCRLCALCACYP3A4

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
WO-2023034466-A1 CGRP ANTAGONISTS FOR TREATING PSORIASIS PFIZER IRELAND PHARMACEUTICALS (IE) 2023-03-09 — — WO claimed
WO-2023034466-A1 CGRP ANTAGONISTS FOR TREATING PSORIASIS PFIZER IRELAND PHARMACEUTICALS (IE) 2023-03-09 — — WO disclosed
Send feedback