SCHEMBL14650659

SCHEMBL14650659

O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1CCCOCCCN1C(=O)c2ccc3c7ccc8c9c(ccc(c%10ccc(c2c3%10)C1=O)c97)C(=O)N(c1ccc(F)cc1F)C8=O)c64)C(=O)N(c1ccc(F)cc1F)C5=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ TERT O14746 7/20 0.43
▸ TOP2A P11388 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ RGS12 O14924 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ PABPC1 P11940 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ ESR2 Q92731 1/20 0.38
▸ ACHE P22303 4/20 0.37
▸ HSD17B10 Q99714 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
SCHEMBL14268812 0.84 ESR1 (0.50) STAT3HIF1ATERTMEN1NPC1
SCHEMBL14650632 0.76 ESR1 (0.37) STAT3HIF1ATERTMEN1ALDH1A1
SCHEMBL14650619 0.76 STAT3 (0.50) STAT3HIF1ATERTTOP2AKDM4E
SCHEMBL14650624 0.75 STAT3 (0.58) STAT3HIF1ATERTTOP2AKDM4E
SCHEMBL14650580 0.75 STAT3 (0.58) STAT3HIF1ATERTTOP2AKDM4E
SCHEMBL10003923 0.75 STAT3 (0.58) STAT3HIF1ATERTTOP2AKDM4E
SCHEMBL11923437 0.73 STAT3 (0.56) STAT3HIF1ATERTTOP2AKDM4E
SCHEMBL10004510 0.73 STAT3 (0.56) STAT3HIF1ATERTTOP2AKDM4E
SCHEMBL11923436 0.73 STAT3 (0.56) STAT3HIF1ATERTTOP2AKDM4E
SCHEMBL11923433 0.72 STAT3 (0.55) STAT3HIF1ATERTTOP2AKDM4E

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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