SCHEMBL14650534

SCHEMBL14650534

COCCOCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCc1ccc(OC)c(OC)c1)C5=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.44
▸ MAPK1 P28482 3/20 0.44
▸ HPGD P15428 2/20 0.44
▸ ALDH1A1 P00352 5/20 0.42
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ HTT P42858 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ HSP90AA1 P07900 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ HEXA P06865 1/20 0.37
▸ HEXB P07686 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ PAX8 Q06710 1/20 0.36

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
SCHEMBL14650523 0.90 GSK3A (0.37) LMNAMAPK1HPGDALDH1A1RAB9A
SCHEMBL14650533 0.88 TERT (0.34) LMNAMAPK1HPGDALDH1A1SMN1; SMN2
SCHEMBL14650518 0.88 TERT (0.34) LMNAMAPK1HPGDALDH1A1SMN1; SMN2
SCHEMBL14650527 0.88 CYP1B1 (0.40) ALDH1A1SMN1; SMN2MAPTRAB9AGAA
SCHEMBL14650596 0.86 LMNA (0.52) LMNAMAPK1HPGDALDH1A1SMN1; SMN2
SCHEMBL14650509 0.85 STAT3 (0.42) LMNAALDH1A1SMN1; SMN2HTTRAB9A
SCHEMBL14650517 0.85 STAT3 (0.42) LMNAALDH1A1SMN1; SMN2HTTRAB9A
SCHEMBL14650603 0.84 TERT (0.34) —
SCHEMBL14650591 0.84 TERT (0.34) —
SCHEMBL14650589 0.83 TERT (0.33) —

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
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