SCHEMBL14650647

SCHEMBL14650647

O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1CCCOCCCN1C(=O)c2ccc3c7ccc8c9c(ccc(c%10ccc(c2c3%10)C1=O)c97)C(=O)N(c1ccc(S(=O)(=O)CCNCCCOCCCCO)cc1)C8=O)c64)C(=O)N(c1ccc(S(=O)(=O)CCNCCCOCCCCO)cc1)C5=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 4/20 0.46
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ RGS12 O14924 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ PABPC1 P11940 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TOP2A P11388 2/20 0.39
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ STAT3 P40763 1/20 0.35
▸ HIF1A Q16665 1/20 0.35

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
SCHEMBL14653895 0.95 TERT (0.43) TERTKDM4EALDH1A1MEN1RGS12
SCHEMBL14650657 0.88 KDM4E (0.43) TERTKDM4EALDH1A1MEN1RGS12
SCHEMBL14650644 0.82 TOP2A (0.34) TERTMEN1RGS12HTTKMT2A
SCHEMBL14650623 0.81 TERT (0.40) TERTMEN1RGS12HTTKMT2A
SCHEMBL14650686 0.81 TERT (0.31) TERT
SCHEMBL14650622 0.81 TERT (0.44) TERTKDM4EALDH1A1MEN1RGS12
SCHEMBL14650583 0.80 TERT (0.30) TERT
SCHEMBL14650675 0.77 STAT3 (0.37) TERTKDM4EALDH1A1MEN1RGS12
SCHEMBL14650656 0.75 CA1 (0.42) TERTKDM4EALDH1A1MEN1RGS12
SCHEMBL14650639 0.75 MMP9 (0.34) TERTCA12CA1CA2CA9

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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