SCHEMBL9049665

SCHEMBL9049665

C[SiH](C)OC(CCC(C=CC1CCCC(=O)C1)C(C)(C)C)Oc1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 4/20 0.32
▸ LTB4R2 Q9NPC1 4/20 0.32
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 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
SCHEMBL8909628 0.94 LTB4R (0.34) LTB4RLTB4R2
SCHEMBL8910179 0.82 LTB4R (0.33) LTB4RLTB4R2CYP3A4CYP2C9CYP2C19
SCHEMBL9051369 0.78 LTB4R (0.50) LTB4RLTB4R2
SCHEMBL8910701 0.76 PDE4A (0.31) —
SCHEMBL8909237 0.74 LTB4R (0.44) LTB4RLTB4R2
SCHEMBL9050982 0.74 THRB (0.32) —
SCHEMBL9050969 0.74 — —
SCHEMBL9051279 0.74 — —
SCHEMBL9046790 0.74 — —
SCHEMBL9051549 0.72 LTB4R (0.52) LTB4RLTB4R2

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-0611755-B1 (Cyclohexyl)-alken compounds, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1996-07-10 — — EP disclosed
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