SCHEMBL29323746

SCHEMBL29323746

Oc1ccc(C2CCC(CC3CCCC3)OC2)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.40
ALOX5 P09917 1/20 0.34
OPRM1 P35372 3/20 0.31
OPRK1 P41145 3/20 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
SCHEMBL29323675 0.95 ALOX5 (0.35) DRD1ALOX5
SCHEMBL12994044 0.80 OPRL1 (0.39) DRD1OPRM1OPRK1
SCHEMBL17528174 0.80 ALOX5 (0.40) DRD1ALOX5
SCHEMBL29322541 0.78 DRD1 (0.35) DRD1ALOX5OPRM1OPRK1
SCHEMBL29323899 0.75 DRD1 (0.34) DRD1
SCHEMBL29323697 0.74 DRD1 (0.33) DRD1
SCHEMBL28204231 0.73 NUDT1 (0.41)
SCHEMBL25929260 0.73 OPRL1 (0.32)
SCHEMBL12223404 0.73 FEN1 (0.36)
SCHEMBL12223881 0.72 ALOX5AP (0.31)

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