SCHEMBL7207372

SCHEMBL7207372

Nc1cccc(N(Cc2ccccc2)Cc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.54
CRHR2 Q13324 1/20 0.54
MAOB P27338 3/20 0.52
MAOA P21397 3/20 0.52
TSHR P16473 3/20 0.50
NR3C1 P04150 1/20 0.50
PTPN1 P18031 2/20 0.49
CYP2C19 P33261 1/20 0.48
CYP3A4 P08684 1/20 0.46
CASP1 P29466 1/20 0.46
RECQL P46063 1/20 0.46
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
CYP2D6 P10635 2/20 0.42
TAAR1 Q96RJ0 2/20 0.42
LMNA P02545 2/20 0.42
CYP1A2 P05177 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42
ADORA3 P0DMS8 1/20 0.42

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
SCHEMBL29892730 1.00 CRHBP (0.54) CRHBPCRHR2MAOBMAOATSHR
SCHEMBL17463837 0.91 MAOB (0.55) CRHBPCRHR2MAOBMAOATSHR
SCHEMBL28107052 0.90 MAOB (0.46) CRHBPCRHR2MAOBMAOATSHR
SCHEMBL18030723 0.90 CARM1 (0.47) CRHBPCRHR2MAOBMAOATSHR
SCHEMBL10974928 0.86 CRHBP (0.68) CRHBPCRHR2TSHRNR3C1PTPN1
SCHEMBL18300919 0.82 CRHBP (0.52) CRHBPCRHR2TSHRNR3C1PTPN1
SCHEMBL16616918 0.81 DHFR (0.49) CRHBPCRHR2MAOBMAOATSHR
SCHEMBL18138726 0.80 MTNR1A (0.57) CRHBPCRHR2TSHRNR3C1PTPN1
SCHEMBL43183 0.79 TSHR (0.74) CRHBPCRHR2TSHRNR3C1PTPN1
SCHEMBL18138798 0.79 CRHBP (0.46) CRHBPCRHR2MAOBMAOATSHR

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-2828339-B1 CARBOXYLATE DYES MILLIKEN & CO (US) 2018-10-31 EP disclosed
US-9187717-B2 Carboxylate dyes MILLIKEN & COMPANY (US) 2015-11-17 US disclosed
US-20150099869-A1 Carboxylate Dyes MILLIKEN & COMPANY 2015-04-09 US disclosed
CN-104350106-A Laundry care compositions containing dyes PROCTER & GAMBLE 2015-02-11 CN disclosed
CN-104220535-A Carboxylate dyes MILLIKEN & CO 2014-12-17 CN disclosed
WO-2003076388-A2 BIS-ANILINE DERIVATIVES USEFUL AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2003-09-18 WO disclosed