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Sugi Predict / Compounds / SCHEMBL6468875

SCHEMBL6468875

SCHEMBL6468875

C1=Cc2c(n(-c3ccccc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)cc23)CC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PTGER4 P35408 1/20 0.35
▸ ABCG2 Q9UNQ0 1/20 0.31
▸ RAC2 P15153 1/20 0.31
▸ RAC3 P60763 1/20 0.31
▸ CDC42 P60953 1/20 0.31
▸ RAC1 P63000 1/20 0.31
▸ NPY5R Q15761 1/20 0.30
▸ PTPN1 P18031 1/20 0.30

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
SCHEMBL9883306 1.00 KDM4E (0.38) KDM4EATML3MBTL1PTGER4ABCG2
SCHEMBL14235019 0.95 KDM4E (0.35) KDM4EATML3MBTL1PTGER4
SCHEMBL12966441 0.95 KDM4E (0.35) KDM4EATML3MBTL1PTGER4ABCG2
SCHEMBL25916046 0.95 KDM4E (0.35) KDM4EATML3MBTL1PTGER4ABCG2
SCHEMBL19801310 0.95 PTGER4 (0.34) KDM4EATML3MBTL1PTGER4ABCG2
SCHEMBL20182816 0.93 KDM4E (0.33) KDM4EATML3MBTL1PTGER4
SCHEMBL23740230 0.93 KDM4E (0.34) KDM4EATML3MBTL1PTGER4
SCHEMBL21319866 0.93 KDM4E (0.35) KDM4EATML3MBTL1PTGER4
SCHEMBL23284364 0.92 L3MBTL1 (0.42) KDM4EATML3MBTL1PTGER4PTPN1
SCHEMBL25073120 0.92 L3MBTL1 (0.42) KDM4EATML3MBTL1PTGER4PTPN1

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
US-20120119197-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-05-17 — — US disclosed
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