SCHEMBL21900259

SCHEMBL21900259

CSc1ccc2c(c1)CCN(C1CCN(C(=O)O)CC1)C(=O)N2

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 18/20 0.40
▸ RAMP1 O60894 4/20 0.40
▸ USP2 O75604 1/20 0.37
▸ CRBN Q96SW2 1/20 0.36

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
SCHEMBL30178430 0.86 GPR119 (0.49) CALCRLRAMP1CRBN
SCHEMBL17881255 0.84 MAPK1 (0.39) CALCRLUSP2
SCHEMBL13806416 0.83 CALCRL (0.41) CALCRLRAMP1CRBN
SCHEMBL19873973 0.83 HTR2A (0.39) CALCRLRAMP1USP2
SCHEMBL4079721 0.82 PDE3B (0.41) CALCRLRAMP1
SCHEMBL2087424 0.80 CALCRL (0.55) CALCRLRAMP1
SCHEMBL3593027 0.73 CALCRL (0.43) CALCRLRAMP1
SCHEMBL13655717 0.72 CALCRL (0.52) CALCRLRAMP1
SCHEMBL30231301 0.71 CALCRL (0.58) CALCRLRAMP1
SCHEMBL2103739 0.71 CALCRL (0.58) CALCRLRAMP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3708566-B1 NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2023-02-08 — — EP disclosed
EP-3708566-A1 NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS Galderma Research & Development (FR) 2020-09-16 — — EP disclosed
EP-3237403-B1 NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2020-05-06 — — EP disclosed
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