SCHEMBL4036263

SCHEMBL4036263

Cc1cccc(-c2ccc(C)[nH]2)n1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.58
CCR8 P51685 1/20 0.58
METAP2 P50579 1/20 0.46
CYP2A6 P11509 1/20 0.42
TGFBR1 P36897 8/20 0.39
NOS3 P29474 1/20 0.39
NOS2 P35228 1/20 0.39
HMBS P08397 1/20 0.39
MAPK14 Q16539 2/20 0.36
RAB9A P51151 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
BRS3 P32247 1/20 0.35
ATP4A P20648 1/20 0.34
ATP4B P51164 1/20 0.34

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
SCHEMBL3745071 0.88 CCR1 (0.62) CCR1CCR8METAP2CYP2A6TGFBR1
SCHEMBL1456972 0.88 CCR1 (0.62) CCR1CCR8METAP2CYP2A6TGFBR1
SCHEMBL16715991 0.86 CCR1 (0.67) CCR1CCR8METAP2CYP2A6TGFBR1
SCHEMBL3754653 0.79 CCR1 (0.52) CCR1CCR8METAP2CYP2A6TGFBR1
SCHEMBL1457181 0.79 CCR1 (0.57) CCR1CCR8METAP2CYP2A6TGFBR1
SCHEMBL3751824 0.79 CCR1 (0.52) CCR1CCR8METAP2CYP2A6TGFBR1
SCHEMBL4037764 0.78 CCR1 (0.50) CCR1CCR8METAP2CYP2A6RAB9A
SCHEMBL196966 0.75 CCR1 (1.00) CCR1CCR8METAP2CYP2A6TGFBR1
SCHEMBL30511194 0.75 CCR1 (1.00) CCR1CCR8METAP2CYP2A6TGFBR1
SCHEMBL29388304 0.75 CCR1 (1.00) CCR1CCR8METAP2CYP2A6TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2069345-A2 PYRIDAZINE AND PYRROLE COMPOUNDS, PROCESSES FOR OBTAINING THEM AND USES Centre National de la Recherche Scientifique (CNRS) (FR) 2009-06-17 EP claimed
WO-2008012440-A2 PYRIDAZINE AND PYRROLE COMPOUNDS, PROCESSES FOR OBTAINING THEM AND USES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2008-01-31 WO claimed
EP-2595997-B1 COPPER(I) COMPLEXES FOR OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2015-09-16 EP disclosed
US-9024026-B2 Copper (I) complexes for optoelectronic devices CYNORA GMBH (DE) 2015-05-05 US disclosed
US-9024026-B2 Copper (I) complexes for optoelectronic devices CYNORA GMBH (DE) 2015-05-05 US disclosed
WO-2014108430-A1 THERMALLY ACTIVATED FLUORESCENCE AND SINGLET HARVESTING WITH RIGID METAL COMPLEXES FOR OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2014-07-17 WO disclosed
US-20130150581-A1 COPPER (I) COMPLEXES FOR OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2013-06-13 US disclosed
US-20130150581-A1 COPPER (I) COMPLEXES FOR OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2013-06-13 US disclosed
WO-2012010650-A1 COPPER (I) COMPLEXES FOR OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2012-01-26 WO disclosed
EP-2069345-A2 PYRIDAZINE AND PYRROLE COMPOUNDS, PROCESSES FOR OBTAINING THEM AND USES Centre National de la Recherche Scientifique (CNRS) (FR) 2009-06-17 EP disclosed
WO-2008012440-A2 PYRIDAZINE AND PYRROLE COMPOUNDS, PROCESSES FOR OBTAINING THEM AND USES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2008-01-31 WO disclosed