SCHEMBL19538265

SCHEMBL19538265

COCC1CC[C@@]23C[C@@H]1C(C)(C)[C@@H]2CC[C@H]3C

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ CYP17A1 P05093 2/20 0.34
▸ CYP19A1 P11511 2/20 0.34

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
SCHEMBL22281629 0.82 ALOX15 (0.41) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL27083612 0.75 ALOX15 (0.51) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL5164350 0.75 ALOX15 (0.51) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL332962 0.75 ALOX15 (0.51) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL22281512 0.70 ALOX15 (0.46) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL18827059 0.68 ALDH1A1 (0.31) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL18827097 0.68 ALDH1A1 (0.31) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL24534431 0.66 ALOX15 (0.65) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL18138230 0.66 ALOX15 (0.65) ALOX15ALDH1A1LMNATHRBMAPK1
SCHEMBL19718041 0.66 ALOX15 (0.65) ALOX15ALDH1A1LMNATHRBMAPK1

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-2017186973-A2 BLENDS CONTAINING ENANTIOMERICALLY PURE AMBROCENIDE® SYMRISE AG (DE) 2017-11-02 — — WO disclosed
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