SCHEMBL16483566

SCHEMBL16483566

c1cc(-c2ccc3c4c(cccc24)-c2ccccc2-3)cc(-n2c3ccccc3c3cc4ccncc4cc32)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HASPIN Q8TF76 7/20 0.40
▸ PIK3CD O00329 1/20 0.38
▸ PIK3CB P42338 1/20 0.38
▸ PIK3CG P48736 1/20 0.38
▸ TNF P01375 1/20 0.38
▸ TDO2 P48775 2/20 0.37
▸ TOP2A P11388 1/20 0.35
▸ PIM1 P11309 3/20 0.34
▸ CLK1 P49759 1/20 0.34
▸ IKBKB O14920 3/20 0.33
▸ CCNT1 O60563 1/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ PRKCI P41743 1/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 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
SCHEMBL16483363 0.90 HASPIN (0.41) HASPINPIK3CDPIK3CBPIK3CGTNF
SCHEMBL16483348 0.90 HASPIN (0.41) HASPINPIK3CDPIK3CBPIK3CGTNF
SCHEMBL16483570 0.90 TNF (0.41) HASPINPIK3CDPIK3CBPIK3CGTNF
SCHEMBL16483590 0.90 TNF (0.39) HASPINPIK3CDPIK3CBPIK3CGTNF
SCHEMBL16483126 0.89 PIK3CD (0.41) HASPINPIK3CDPIK3CBPIK3CGTNF
SCHEMBL16483148 0.89 PIK3CD (0.41) HASPINPIK3CDPIK3CBPIK3CGTNF
SCHEMBL17341227 0.89 L3MBTL1 (0.39) KDM4EATML3MBTL1
SCHEMBL16483591 0.87 MAOA (0.40) TNFTOP2AKDM4EATML3MBTL1
SCHEMBL16483607 0.87 DYRK1A (0.38) TNFTOP2AKDM4EATML3MBTL1
SCHEMBL17341423 0.85 ALDH1A1 (0.41) KDM4EATML3MBTL1MAPT

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-2014057873-A1 PHOSPHINE OXIDE DERIVATIVE AND LIGHT-EMITTING ELEMENT PROVIDED WITH SAME 東レ株式会社 (JP) 2014-04-17 — — WO disclosed
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