SCHEMBL23447040

SCHEMBL23447040

CC1(C)CCC(C)(C)c2cc3occ(Nc4ccc(C(C)(C)C)cc4)c3cc2C1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 1/20 0.31

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
SCHEMBL23442562 0.88 AKR1C3 (0.35) OPRD1
SCHEMBL30872231 0.73 AKR1C3 (0.40) —
SCHEMBL23450954 0.73 AKR1C3 (0.40) —
SCHEMBL26404888 0.69 PIN1 (0.34) —
SCHEMBL23446347 0.68 KDM4E (0.34) —
SCHEMBL23439027 0.68 CYP26A1 (0.46) OPRD1
SCHEMBL24509571 0.68 AKR1C3 (0.37) —
SCHEMBL21307811 0.67 ALDH1A1 (0.42) —
SCHEMBL26410429 0.67 AKR1C3 (0.39) OPRD1
SCHEMBL23116372 0.66 CYP26A1 (0.47) OPRD1

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
WO-2021107680-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-06-03 — — WO disclosed
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