SCHEMBL24469233

SCHEMBL24469233

c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5cccc6sc7c8ccccc8ccc7c56)cc4)c4ccccc34)c3ccccc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 5/20 0.42
CYP1B1 Q16678 5/20 0.42
LIMK1 P53667 1/20 0.39
F9 P00740 1/20 0.39
CYP1A2 P05177 3/20 0.36
TNF P01375 1/20 0.35
CA12 O43570 3/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA9 Q16790 3/20 0.34
ALOX5 P09917 1/20 0.33
ENPP1 P22413 1/20 0.33
SOS1 Q07889 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
PPARG P37231 3/20 0.32
PPARA Q07869 3/20 0.32
CDK4 P11802 1/20 0.32
CCND1 P24385 1/20 0.32
CYP2C9 P11712 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
SCHEMBL24469323 0.95 CYP1A1 (0.46) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469228 0.94 CYP1A1 (0.43) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469327 0.94 CYP1A1 (0.45) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24481926 0.94 CYP1A1 (0.45) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL18996159 0.91 CA12 (0.39) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL21687083 0.91 CYP1A1 (0.45) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL18266968 0.91 CYP1A1 (0.47) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469299 0.89 CYP1A1 (0.40) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24469232 0.89 CYP1A1 (0.44) CYP1A1CYP1B1LIMK1F9CYP1A2
SCHEMBL24178658 0.88 LIMK1 (0.41) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220393110-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT, COMPOSITION, POWDER, ELECTRONIC EQUIPMENT, AND NOVEL COMPOUND IDEMITSU KOSAN CO.,LTD. (CN) 2022-12-08 US disclosed
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