SCHEMBL9408384

SCHEMBL9408384

C=CCC(C(=O)O)[C@H]1CC[C@H](c2ccc(CCC)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.41
▸ THRB P10828 2/20 0.40
▸ SPHK1 Q9NYA1 6/20 0.39
▸ MMP2 P08253 1/20 0.35
▸ MMP3 P08254 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35

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
SCHEMBL9408373 1.00 FFAR4 (0.41) FFAR4THRBSPHK1MMP2MMP3
SCHEMBL9408375 0.96 FFAR4 (0.39) FFAR4THRBSPHK1MMP2MMP3
SCHEMBL9408362 0.96 FFAR4 (0.39) FFAR4THRBSPHK1MMP2MMP3
SCHEMBL9408201 0.90 FFAR4 (0.37) FFAR4CYP2C9SLC6A3
SCHEMBL9408187 0.87 FFAR4 (0.35) FFAR4CYP2C9SLC6A3
SCHEMBL9408448 0.85 SLC6A2 (0.39) FFAR4CYP2C9SLC6A3
SCHEMBL9408458 0.85 SLC6A2 (0.39) FFAR4CYP2C9SLC6A3
SCHEMBL9408269 0.83 PRCP (0.37) FFAR4CYP2C9
SCHEMBL9408262 0.82 THRB (0.41) FFAR4THRBSPHK1MMP2MMP3
SCHEMBL9408251 0.82 THRB (0.41) FFAR4THRBSPHK1MMP2MMP3

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-0595144-A1 Cyclohexyl alkenoates as components of liquid crystalline mixtures F. HOFFMANN-LA ROCHE AG (CH) 1994-05-04 — — EP disclosed
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