SCHEMBL14650549

SCHEMBL14650549

COCCOCC(C)OCC(C)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(c1cccc2ccccc12)C5=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.40
▸ KMT2A Q03164 9/20 0.38
▸ MEN1 O00255 5/20 0.38
▸ ALDH1A1 P00352 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ FNTA P49354 1/20 0.35
▸ FNTB P49356 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ENPP2 Q13822 1/20 0.35
▸ ELANE P08246 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ PKM P14618 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ HTT P42858 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ LMNA P02545 2/20 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
SCHEMBL14650542 0.86 ALDH1A1 (0.36) POLBKMT2AMEN1ALDH1A1GAA
SCHEMBL14650621 0.85 POLB (0.50) POLBKMT2AMEN1ALDH1A1GAA
SCHEMBL14650603 0.85 TERT (0.34) —
SCHEMBL14650591 0.85 TERT (0.34) —
SCHEMBL14650521 0.85 KDM4E (0.41) ALDH1A1GAAKDM4EL3MBTL1HEXA
SCHEMBL14650550 0.85 ALDH1A1 (0.35) POLBKMT2AMEN1ALDH1A1GAA
SCHEMBL14650589 0.84 TERT (0.33) —
SCHEMBL14650605 0.84 TERT (0.33) —
SCHEMBL14650558 0.83 MCHR1 (0.41) POLBKMT2AMEN1ALDH1A1USP2
SCHEMBL14650648 0.82 PRMT1 (0.36) KMT2AMEN1ALDH1A1GAAUSP2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9051468-B2 Dyes for polymer coloration, their preparation and their use CLARIANT INTERNATIONAL LTD (CH) 2015-06-09 — — US disclosed
US-20130019415-A1 DYES FOR POLYMER COLORATION, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2013-01-24 — — US disclosed
Send feedback