SCHEMBL25879088

SCHEMBL25879088

c1ccc(-c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4ccc5sc6ccccc6c5c4c3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F9 P00740 1/20 0.36
▸ CDK4 P11802 3/20 0.33
▸ CCND1 P24385 3/20 0.33
▸ CCNB2 O95067 1/20 0.33
▸ CCNE2 O96020 1/20 0.33
▸ CDK1 P06493 1/20 0.33
▸ CCNB1 P14635 1/20 0.33
▸ CCNE1 P24864 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ CCNB3 Q8WWL7 1/20 0.33
▸ GPR3 P46089 1/20 0.32
▸ CHEK1 O14757 1/20 0.31
▸ WEE1 P30291 1/20 0.31
▸ APP P05067 1/20 0.31
▸ ALOX5 P09917 1/20 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

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
SCHEMBL25879091 0.94 CDK4 (0.36) F9CDK4CCND1CCNB2CCNE2
SCHEMBL25878766 0.94 GPR3 (0.34) F9CDK4CCND1GPR3APP
SCHEMBL25879226 0.94 GPR3 (0.34) F9CDK4CCND1GPR3APP
SCHEMBL25879019 0.93 F9 (0.32) F9CDK4CCND1GPR3CHEK1
SCHEMBL25882623 0.93 F9 (0.37) F9CDK4CCND1CCNB2CCNE2
SCHEMBL25878768 0.93 MCL1 (0.37) F9MCL1
SCHEMBL25878925 0.92 GPR3 (0.35) F9CDK4CCND1GPR3APP
SCHEMBL25879089 0.92 F9 (0.39) F9CDK4CCND1CCNB2CCNE2
SCHEMBL25879718 0.91 F9 (0.35) F9CDK4CCND1GPR3CHEK1
SCHEMBL25879227 0.91 GPR3 (0.38) GPR3APPMEN1POLBMAPT

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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