SCHEMBL29324369

SCHEMBL29324369

CCCC1CC=C(c2ccc(OC3CCCC3)c(F)c2F)CC1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 1/20 0.35
NPY2R P49146 1/20 0.35
CSNK2A1 P68400 1/20 0.32
POLB P06746 1/20 0.31
CARM1 Q86X55 1/20 0.31
PRMT1 Q99873 1/20 0.31
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 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 0.93 NPY1R (0.32) NPY1RNPY2RCSNK2A1
SCHEMBL29324397 0.92 NPY1R (0.31) NPY1RNPY2RCSNK2A1PDE4BPDE4D
SCHEMBL29324358 0.91 NPY1R (0.34) NPY1RNPY2RCSNK2A1POLBCARM1
SCHEMBL29324693 0.88 NPY1R (0.34) NPY1RNPY2RCARM1PRMT1
SCHEMBL21655261 0.88 NPY1R (0.31) NPY1RNPY2R
SCHEMBL31722819 0.85 NPC1 (0.34)
SCHEMBL13378230 0.85 NPC1 (0.34)
SCHEMBL29324431 0.85 PTGDR2 (0.31)
SCHEMBL9405831 0.85 ESR2 (0.37)
SCHEMBL9405850 0.82 NPC1 (0.32)

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