SCHEMBL5142143

SCHEMBL5142143

C=C(CC(C)(CC=C(CC)c1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
MAOA P21397 5/20 0.32
MAOB P27338 5/20 0.32
ATM Q13315 1/20 0.30
DRD2 P14416 1/20 0.30
OPRM1 P35372 1/20 0.30
DRD3 P35462 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
SCHEMBL15670832 0.83 CYP2C19 (0.40) CYP2C19HIF1AMAOAMAOB
SCHEMBL2047123 0.79 CYP2C19 (0.47) CYP2C19HIF1AMAOAMAOB
SCHEMBL7172775 0.73 CYP2C19 (0.44) CYP2C19HIF1AMAOAMAOB
SCHEMBL29130605 0.72 CYP2C19 (0.41) CYP2C19HIF1AMAOAMAOB
SCHEMBL10624695 0.72 TRPA1 (0.39) CYP2C19HIF1AMAOAMAOBATM
SCHEMBL14921 0.71 TAAR1 (0.48) CYP2C19HIF1AMAOAMAOB
SCHEMBL296800 0.70 MAOA (0.42) CYP2C19HIF1AMAOAMAOB
SCHEMBL7169023 0.68 CYP2C19 (0.46) CYP2C19HIF1AATM
SCHEMBL7169027 0.68 CYP2C19 (0.46) CYP2C19HIF1AATM
SCHEMBL3962527 0.68 ATM (0.45) MAOAMAOBATM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9080124-B2 Use of graft polymers EVONIK ROHMAX ADDITIVES GMBH (DE) 2015-07-14 US disclosed
US-20070213237-A1 USE OF GRAFT POLYMERS ROHMAX ADDITIVES GMBH (DE) 2007-09-13 US disclosed