SCHEMBL29324397

SCHEMBL29324397

CCCCCC1CC=C(c2ccc(OC3CCCC3)c(F)c2F)CC1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 1/20 0.31
NPY2R P49146 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4D Q08499 1/20 0.31
HTR1D P28221 1/20 0.31
CSNK2A1 P68400 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
SCHEMBL29324383 0.97 NPY1R (0.32) NPY1RNPY2RCSNK2A1
SCHEMBL29324369 0.92 NPY1R (0.35) NPY1RNPY2RPDE4BPDE4DCSNK2A1
SCHEMBL29324721 0.89 CARM1 (0.31) NPY1RNPY2R
SCHEMBL29324358 0.88 NPY1R (0.34) NPY1RNPY2RPDE4BPDE4DCSNK2A1
SCHEMBL9419258 0.86 CCNT1 (0.31)
SCHEMBL9419300 0.86 CCNT1 (0.34)
SCHEMBL29324453 0.86 CYP1A2 (0.30)
SCHEMBL9406033 0.86 ESR2 (0.35) HTR1D
SCHEMBL29324705 0.85 CARM1 (0.31) NPY1RNPY2R
SCHEMBL9419271 0.85 CCNT1 (0.30)

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