SCHEMBL18633823

SCHEMBL18633823

CC(C)(O)C1C=CC2=C(C1)/C(=C/CCN1CC[C@@H](N(CC(=O)O)Cc3ccc(Cl)cc3)C1)C1=C(CO2)NCC=C1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NR1D1 P20393 1/20 0.32

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
SCHEMBL14420171 0.75 CCR1 (0.40) —
SCHEMBL18895961 0.75 CCR1 (0.41) NR1D1
SCHEMBL18895965 0.72 OPRM1 (0.30) —
SCHEMBL18633617 0.71 CCR1 (0.41) —
SCHEMBL14579858 0.71 — —
SCHEMBL15478324 0.71 CCR1 (0.39) —
SCHEMBL18633616 0.70 CCR1 (0.36) —
SCHEMBL18896016 0.70 CCR1 (0.40) —
SCHEMBL18895968 0.70 CCR1 (0.40) —
SCHEMBL18896015 0.69 CCR1 (0.38) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1688418-B1 Chemokine receptor antagonists and methods of use thereof MILLENNIUM PHARM INC (US) 2017-03-15 — — EP disclosed
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