SCHEMBL29324373

SCHEMBL29324373

CCCC1CC=C(c2ccc(CC3CCCC3)c(F)c2F)CC1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 3/20 0.34
ALOX5AP P20292 2/20 0.31
ESR2 Q92731 1/20 0.30

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
SCHEMBL29324387 0.93 CYP1A2 (0.36) FEN1ALOX5AP
SCHEMBL29324365 0.90 FEN1 (0.36) FEN1ALOX5APESR2
SCHEMBL29324696 0.88 FEN1 (0.32) FEN1
SCHEMBL9405831 0.87 ESR2 (0.37) ESR2
SCHEMBL29324433 0.85 CEL (0.36)
SCHEMBL8938664 0.83 ESR2 (0.38) ESR2
SCHEMBL8938676 0.82 ESR2 (0.37) ESR2
SCHEMBL9405919 0.82 ESR2 (0.34) ESR2
SCHEMBL29324712 0.81 CYP1A2 (0.35) FEN1
SCHEMBL29324422 0.81 CEL (0.33) ESR2

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-4400561-A1 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2024-07-17 EP disclosed