SCHEMBL9019415

SCHEMBL9019415

[C]1=C(C2c3ccccc3-c3ccccc32)C=CC1=C1CCC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.32
BCHE P06276 1/20 0.31
ACHE P22303 1/20 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
SCHEMBL7024410 0.66 POLB (0.37) HTR2AACHE
SCHEMBL29047783 0.64 HTR2A (0.43) HTR2ABCHEACHE
SCHEMBL7592004 0.63 HTR2A (0.32) HTR2A
SCHEMBL29047784 0.62 BCHE (0.42) HTR2ABCHEACHE
SCHEMBL816150 0.62 HTR2A (0.38) HTR2ABCHEACHE
SCHEMBL29116619 0.62 HTR2A (0.50) HTR2A
SCHEMBL10455248 0.61 POLB (0.33) HTR2A
SCHEMBL7025553 0.60 HTR2A (0.33) HTR2A
SCHEMBL25171318 0.56 LMNA (0.54) HTR2A
SCHEMBL9297178 0.56 HTR2A (0.48) HTR2ABCHEACHE

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-0609439-B1 PROCESS FOR PRODUCING POLYOLEFIN IDEMITSU PETROCHEMICAL CO (JP) 1996-11-27 EP disclosed