SCHEMBL24469342

SCHEMBL24469342

c1ccc(-c2ccc(-c3ccccc3)c(-c3c4ccccc4c(-c4cccc5sc6c7ccccc7ccc6c45)c4ccccc34)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 5/20 0.43
CYP1B1 Q16678 5/20 0.43
CYP1A2 P05177 3/20 0.38
F9 P00740 3/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
LIMK1 P53667 2/20 0.35
ALOX5 P09917 1/20 0.34
SOS1 Q07889 1/20 0.34
NQO1 P15559 1/20 0.33
NQO2 P16083 1/20 0.33
MEN1 O00255 1/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL24481922 0.93 CYP1A1 (0.43) CYP1A1CYP1B1CYP1A2F9CA12
SCHEMBL21687084 0.89 CYP1A1 (0.46) CYP1A1CYP1B1CYP1A2F9CA12
SCHEMBL21687083 0.89 CYP1A1 (0.45) CYP1A1CYP1B1CYP1A2F9CA12
SCHEMBL24481926 0.89 CYP1A1 (0.45) CYP1A1CYP1B1CYP1A2F9CA12
SCHEMBL24469299 0.87 CYP1A1 (0.40) CYP1A1CYP1B1CYP1A2F9CA12
SCHEMBL24469334 0.87 CYP1A1 (0.39) CYP1A1CYP1B1CYP1A2F9CA12
SCHEMBL24469232 0.87 CYP1A1 (0.44) CYP1A1CYP1B1CYP1A2F9CA12
SCHEMBL24469228 0.86 CYP1A1 (0.43) CYP1A1CYP1B1CYP1A2F9CA12
SCHEMBL24469337 0.86 CYP1A1 (0.46) CYP1A1CYP1B1CYP1A2F9CA12
SCHEMBL24469327 0.86 CYP1A1 (0.45) CYP1A1CYP1B1CYP1A2F9CA12

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-20220173334-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS EQUIPPED WITH THE SAME IDEMITSU KOSAN CO.,LTD. (JP) 2022-06-02 US disclosed
US-20220173335-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPARATUS EQUIPPED WITH THE SAME IDEMITSU KOSAN CO.,LTD. (JP) 2022-06-02 US disclosed