SCHEMBL8089494

SCHEMBL8089494

CCc1ccc(Cl)c(CC)c1CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 2/20 0.40
GABRA1 P14867 3/20 0.37
GABRB2 P47870 3/20 0.37
HTR2A P28223 4/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
CLCN2 P51788 1/20 0.33
SLC6A4 P31645 1/20 0.33
KCNH2 Q12809 1/20 0.33
HTR2C P28335 3/20 0.33
HTR2B P41595 3/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
AKR1B1 P15121 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
Ammonia Solution, Strong SCHEMBL233672 0.98 CTRC (0.39) CTRCGABRA1GABRB2HTR2AGRIN2D
SCHEMBL4740605 0.87 CSNK2A2 (0.38) CTRCGABRA1GABRB2HTR2ACLCN2
Ammonia Solution, Strong SCHEMBL10711080 0.84 TAAR1 (0.35) CTRCGABRA1GABRB2PTGS1PTGS2
SCHEMBL29619533 0.84 GABRA1 (0.41) CTRCGABRA1GABRB2GRIN2DGRIN3B
SCHEMBL166573 0.84 GABRA1 (0.41) CTRCGABRA1GABRB2GRIN2DGRIN3B
SCHEMBL2662577 0.83 CTRC (0.39) CTRCGABRA1GABRB2HTR2AGRIN2D
SCHEMBL13964561 0.81 CTRC (0.38) CTRCGABRA1GABRB2HTR2AGRIN2D
Ammonia Solution, Strong SCHEMBL27539208 0.81 GABRA1 (0.39) CTRCGABRA1GABRB2GRIN2DGRIN3B
SCHEMBL28159693 0.80 CTRC (0.41) CTRCCLCN2CSNK2A2CSNK2BCSNK2A1
SCHEMBL398748 0.79 CTRC (0.36) CTRCGABRA1GABRB2HTR2AGRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1275998-C Poly-fluorene luminescent materials with carrier balance implantation and transmission and method for preparing same UNIV FUDAN (CN) 2006-09-20 CN disclosed
CN-1632047-A Poly-fluorene luminescent materials with carrier balance implantation and transmission and method for preparing same UNIV FUDAN (CN) 2005-06-29 CN disclosed
EP-1053990-A2 A method of producing an aromatic ketone and an aromatic ketone composition containing it TORAY INDUSTRIES, INC. (JP) 2000-11-22 EP disclosed