SCHEMBL29328358

SCHEMBL29328358

C1=C(C2CCCCC2)CCC(C2CCCCC2)C1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL18472980 0.79
SCHEMBL13645506 0.75
Biphenyl SCHEMBL8632177 0.75 KDM1A (0.44) ALDH1A1
SCHEMBL13782970 0.75
SCHEMBL11713974 0.73 TLR4 (0.32)
SCHEMBL4590084 0.72 KDM1A (0.41) ALDH1A1
SCHEMBL12812287 0.72 ALDH1A1 (0.35) ALDH1A1
SCHEMBL13782639 0.72 ALDH1A1 (0.35) ALDH1A1
SCHEMBL13645477 0.72 ALDH1A1 (0.35) ALDH1A1
SCHEMBL1780082 0.72 MAPT (0.35)

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