SCHEMBL24469231

SCHEMBL24469231

c1ccc(-c2ccccc2-c2c3ccccc3c(-c3cccc(-c4cccc5sc6c7ccccc7ccc6c45)c3)c3ccccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 5/20 0.44
CYP1B1 Q16678 5/20 0.44
LIMK1 P53667 1/20 0.41
F9 P00740 1/20 0.38
CYP1A2 P05177 3/20 0.37
ALOX5 P09917 1/20 0.35
SOS1 Q07889 1/20 0.34
CDK4 P11802 4/20 0.33
CCND1 P24385 4/20 0.33
NQO1 P15559 1/20 0.33
NQO2 P16083 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ANPEP P15144 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CCNB2 O95067 1/20 0.32
CCNE2 O96020 1/20 0.32
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
CCNE1 P24864 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
SCHEMBL24469326 0.94 CYP1A1 (0.47) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469228 0.93 CYP1A1 (0.43) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469227 0.93 CYP1A1 (0.46) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469325 0.91 CYP1A1 (0.45) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469232 0.90 CYP1A1 (0.44) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL21687084 0.90 CYP1A1 (0.46) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24481922 0.89 CYP1A1 (0.43) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469323 0.89 CYP1A1 (0.46) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469268 0.88 CYP1A1 (0.42) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469337 0.88 CYP1A1 (0.46) CYP1A1CYP1B1LIMK1F9CYP1A2

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