SCHEMBL25883173

SCHEMBL25883173

c1ccc(N(c2ccc(-c3ccc4ccc5sc6ccccc6c5c4c3)cc2)c2ccc3sc4ccccc4c3c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.35
▸ CDK4 P11802 1/20 0.34
▸ CCND1 P24385 1/20 0.34
▸ PIM3 Q86V86 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ DUSP3 P51452 2/20 0.32
▸ PTPN7 P35236 1/20 0.32
▸ PTPN12 Q05209 1/20 0.32
▸ PTPN22 Q9Y2R2 1/20 0.32
▸ LIMK1 P53667 1/20 0.32
▸ F9 P00740 2/20 0.32
▸ MAPT P10636 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ APP P05067 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ POLB P06746 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
SCHEMBL25882209 0.97 CDK4 (0.37) GPR3CDK4CCND1PIM3CYP1A2
SCHEMBL25883057 0.97 GPR3 (0.37) GPR3CDK4CCND1PIM3CYP1A2
SCHEMBL25882202 0.95 GPR3 (0.37) GPR3CDK4CCND1PIM3CYP1A2
SCHEMBL25879231 0.95 CDK4 (0.37) GPR3CDK4CCND1PIM3CYP1A2
SCHEMBL25883067 0.94 MAPT (0.36) GPR3CDK4CCND1PIM3DUSP3
SCHEMBL25886423 0.94 GPR3 (0.34) GPR3CDK4CCND1PIM3CYP1A2
SCHEMBL25883056 0.94 MAPT (0.36) GPR3CDK4CCND1PIM3DUSP3
SCHEMBL25878770 0.94 CDK4 (0.39) GPR3CDK4CCND1PIM3CYP1A2
SCHEMBL25878766 0.94 GPR3 (0.34) GPR3CDK4CCND1PIM3CYP1A2
SCHEMBL25883167 0.94 GPR3 (0.40) GPR3CYP1A2DUSP3PTPN7PTPN12

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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