SCHEMBL25879445

SCHEMBL25879445

c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4c(ccc5sc6ccccc6c54)c3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F9 P00740 3/20 0.33
▸ APP P05067 1/20 0.33
▸ CDK4 P11802 3/20 0.32
▸ CCND1 P24385 3/20 0.32
▸ ESR1 P03372 2/20 0.32
▸ ESR2 Q92731 2/20 0.32
▸ LIMK1 P53667 1/20 0.31
▸ GPR3 P46089 1/20 0.31
▸ NQO1 P15559 1/20 0.31
▸ NQO2 P16083 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ HSD17B1 P14061 1/20 0.31
▸ CYP2B6 P20813 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ HSD17B2 P37059 1/20 0.31
▸ CYP1A1 P04798 1/20 0.31
▸ CYP1B1 Q16678 1/20 0.31

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
SCHEMBL25879522 1.00 F9 (0.33) F9APPCDK4CCND1ESR1
SCHEMBL25879915 1.00 F9 (0.33) F9APPCDK4CCND1ESR1
SCHEMBL25879731 1.00 F9 (0.33) F9APPCDK4CCND1ESR1
SCHEMBL25879737 0.98 F9 (0.36) F9APPCDK4CCND1ESR1
SCHEMBL25879526 0.98 F9 (0.33) F9APPESR1ESR2LIMK1
SCHEMBL25879530 0.98 F9 (0.36) F9APPCDK4CCND1ESR1
SCHEMBL25879918 0.98 F9 (0.36) F9APPCDK4CCND1ESR1
SCHEMBL25879448 0.98 F9 (0.36) F9APPCDK4CCND1ESR1
SCHEMBL25879378 0.96 GPR3 (0.33) F9APPESR1ESR2LIMK1
SCHEMBL25880054 0.96 GPR3 (0.33) F9APPESR1ESR2LIMK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 — — WO disclosed
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