SCHEMBL14552147

SCHEMBL14552147

Cc1ccc(-c2cc(C)nc3c2ccc2c(-c4ccc(C)cc4)cc(C)nc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.47
GRM2 Q14416 4/20 0.44
COMT P21964 1/20 0.40
IKBKB O14920 1/20 0.39
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 4/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
CA12 O43570 2/20 0.38
CA9 Q16790 2/20 0.38
HPGD P15428 2/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ENPP1 P22413 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.35

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
SCHEMBL17612274 0.93 CRHR1 (0.46) CRHR1KDM4EALDH1A1NPC1RAB9A
SCHEMBL14552169 0.87 NPBWR1 (0.43) CRHR1GRM2NPC1RAB9ASMN1; SMN2
SCHEMBL12727918 0.85 USP7 (0.44) MEN1KMT2ACA12CA9MAPT
SCHEMBL4404687 0.85 CRHR1 (0.46) CRHR1KDM4EALDH1A1NPC1RAB9A
SCHEMBL12755077 0.84 HTT (0.50) CRHR1GRM2IKBKBKDM4EALDH1A1
Bathocuproine SCHEMBL29356702 0.84 CRHR1 (0.48) CRHR1KDM4EALDH1A1NPC1RAB9A
Bathocuproine SCHEMBL20526077 0.84 CRHR1 (0.48) CRHR1KDM4EALDH1A1NPC1RAB9A
Bathocuproine SCHEMBL36914 0.84 CRHR1 (0.48) CRHR1KDM4EALDH1A1NPC1RAB9A
Bathocuproine SCHEMBL29351092 0.84 CRHR1 (0.48) CRHR1KDM4EALDH1A1NPC1RAB9A
Bathocuproine SCHEMBL5398100 0.82 CRHR1 (0.47) CRHR1KDM4EALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9397294-B2 Vertically phase-separating semiconducting organic material layers SOLVAY USA, INC. (US) 2016-07-19 US disclosed
US-20130009137-A1 VERTICALLY PHASE-SEPARATING SEMICONDUCTING ORGANIC MATERIAL LAYERS PLEXTRONICS, INC. 2013-01-10 US disclosed