SCHEMBL8077336

SCHEMBL8077336

COC1(N)C=CC(c2ccccc2)C=C1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 18/20 0.38
MAOA P21397 18/20 0.38
MAOB P27338 18/20 0.38
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32

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
SCHEMBL5185255 0.80 POLB (0.34) KDM1AMAOAMAOB
SCHEMBL7511837 0.77 KDM1A (0.40) KDM1AMAOAMAOBHTR2AHTR2C
SCHEMBL1074533 0.77 KDM1A (0.40) KDM1AMAOAMAOBHTR2AHTR2C
SCHEMBL9466795 0.77 CHRNA7 (0.34) KDM1AMAOAMAOB
SCHEMBL5576897 0.77 KDM1A (0.31) KDM1AMAOAMAOB
SCHEMBL7430840 0.77 KDM1A (0.31) KDM1AMAOAMAOB
SCHEMBL9220720 0.77 KDM1A (0.35) KDM1AMAOAMAOBHTR2AHTR2C
Methane SCHEMBL16507862 0.75 KDM1A (0.39) KDM1AMAOAMAOBHTR2AHTR2C
SCHEMBL3786291 0.75 IDO1 (0.38) KDM1AMAOAMAOB
Propane SCHEMBL23045273 0.74 KDM1A (0.43) KDM1AMAOAMAOBHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2699572-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 EP disclosed
WO-2012143143-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 WO disclosed
EP-1027387-A1 DOUBLE REACTIVE DYES BASF AKTIENGESELLSCHAFT (DE) 2000-08-16 EP disclosed
EP-1000123-A2 USE OF REACTIVE DYES FOR DYEING HAIR BASF AKTIENGESELLSCHAFT (DE) 2000-05-17 EP disclosed
WO-1999023169-A1 DOUBLE REACTIVE DYES BASF AKTIENGESELLSCHAFT (DE) 1999-05-14 WO disclosed
WO-1999005222-A2 USE OF REACTIVE DYES FOR DYEING HAIR BASF AKTIENGESELLSCHAFT (DE) 1999-02-04 WO disclosed