SCHEMBL1283643

SCHEMBL1283643

CC[C](c1ccccc1)c1ccccc1CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.44
CES1 P23141 2/20 0.44
CLCN2 P51788 1/20 0.41
ATM Q13315 1/20 0.41
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
HTT P42858 3/20 0.37
MAPT P10636 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TSHR P16473 1/20 0.37
LMNA P02545 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
AKR1C3 P42330 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 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
SCHEMBL5528072 0.78 ESR1 (0.46) CES2CES1CLCN2ATMGABRA1
SCHEMBL219736 0.78 ATM (0.54) CES2CES1ATMMAPTL3MBTL1
SCHEMBL6546180 0.78 MEN1 (0.42) CES2CES1CLCN2ATMGABRA1
SCHEMBL29881091 0.78 AKR1C3 (0.57) CLCN2MAPTL3MBTL1TSHRAKR1C3
SCHEMBL723171 0.78 AKR1C3 (0.57) CLCN2MAPTL3MBTL1TSHRAKR1C3
SCHEMBL3949381 0.78 ATM (0.47) CES2CES1ATMSMN1; SMN2TSHR
SCHEMBL1286085 0.77 CES2 (0.41) CES2CES1CLCN2ATMGABRA1
SCHEMBL28142585 0.77 CES2 (0.41) CES2CES1CLCN2ATMGABRA1
SCHEMBL5704111 0.76 CES2 (0.56) CES2CES1CLCN2MAPT
Benzophenone SCHEMBL28431035 0.76 ALDH1A1 (0.56) ATMMAPTL3MBTL1LMNAAKR1C3

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-9099657-B2 Photoelectric conversion element and solar cell KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2015-08-04 US disclosed
US-20120085411-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2012-04-12 US disclosed