SCHEMBL6894811

SCHEMBL6894811

N#Cc1cccc(CCc2ccccc2)c1C#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.44
MAOA P21397 3/20 0.42
MAOB P27338 3/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
FFAR1 O14842 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
HIF1A Q16665 1/20 0.40
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40
NRP1 O14786 1/20 0.37
CTSB P07858 1/20 0.37
KCNH2 Q12809 1/20 0.37
ATP4A P20648 1/20 0.37
ATP4B P51164 1/20 0.37
DHFR P00374 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL2507390 0.85 FFAR1 (0.48) MAOAMAOBKDM4EHPGDTSHR
SCHEMBL22871149 0.81 NRP1 (0.37) GRM2FFAR1NRP1KCNH2
SCHEMBL8409516 0.81 FFAR1 (0.43) GRM2MAOAMAOBKDM4EHPGD
SCHEMBL28452232 0.78 AR (0.43) MAOAMAOBKDM4EHPGDTSHR
SCHEMBL28042110 0.76 MAOA (0.45) MAOAMAOBHPGDTSHRHSD17B10
SCHEMBL5499472 0.76 FFAR1 (0.51) FFAR1
SCHEMBL8409148 0.76 HTR1A (0.53) MAOBFFAR1HTR1ADRD2
SCHEMBL8861003 0.75 NPC1 (0.40) MAOAMAOBHPGDTSHRSMN1; SMN2
SCHEMBL6952816 0.74 FFAR1 (0.46) MAOAMAOBKDM4EHPGDTSHR
SCHEMBL2154210 0.74 SMN1; SMN2 (0.49) KDM4EHPGDTSHRHSD17B10FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6783796-B2 Method of manufacturing an electronic device KABUSHIKI KAISHA TOSHIBA (JP) 2004-08-31 US disclosed
US-20030087064-A1 Electronic device and method of manufacturing the same KABUSHIKI KAISHA TOSHIBA (JP) 2003-05-08 US disclosed
US-6447879-B1 Electronic Device and method of manufacturing the same KABUSHIKI KAISHA TOSHIBA (JP) 2002-09-10 US disclosed
US-3984452-A Process for the preparation of a p,p'-dicyanobibenzyl and a m,m'-dicyanobibenzyl AKZONA INCORPORATED (US) 1976-10-05 US disclosed