SCHEMBL25879097

SCHEMBL25879097

c1ccc(-c2ccc(-c3ccc(N(c4cccc(-c5ccccc5)c4)c4ccc5ccc6sc7ccccc7c6c5c4)cc3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 4/20 0.37
▸ CCND1 P24385 4/20 0.37
▸ F9 P00740 3/20 0.34
▸ APP P05067 1/20 0.33
▸ GPR3 P46089 1/20 0.32
▸ LIMK1 P53667 1/20 0.32
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1B1 Q16678 1/20 0.32
▸ ESR1 P03372 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ PIM3 Q86V86 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ DUSP3 P51452 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ PTPN5 P54829 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PTPN11 Q06124 1/20 0.31
▸ MCL1 Q07820 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
SCHEMBL25879012 1.00 CDK4 (0.37) CDK4CCND1F9APPGPR3
SCHEMBL25878926 1.00 CDK4 (0.37) CDK4CCND1F9APPGPR3
SCHEMBL25879104 0.97 CDK4 (0.40) CDK4CCND1F9APPGPR3
SCHEMBL25879016 0.97 CDK4 (0.40) CDK4CCND1F9APPGPR3
SCHEMBL25878933 0.97 CDK4 (0.40) CDK4CCND1F9APPGPR3
SCHEMBL25879013 0.97 CDK4 (0.34) CDK4CCND1F9APPGPR3
SCHEMBL25878766 0.96 GPR3 (0.34) CDK4CCND1F9APPGPR3
SCHEMBL25879226 0.96 GPR3 (0.34) CDK4CCND1F9APPGPR3
SCHEMBL25878937 0.95 CDK4 (0.34) CDK4CCND1F9APPCYP1A1
SCHEMBL23512003 0.95 CDK4 (0.36) CDK4CCND1F9APPGPR3

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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