SCHEMBL14650580

SCHEMBL14650580

CCCCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCCOCCCN1C(=O)c2ccc3c4ccc6c7c(ccc(c8ccc(c2c38)C1=O)c74)C(=O)N(CCCC)C6=O)C5=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.58
▸ HIF1A Q16665 1/20 0.58
▸ TERT O14746 8/20 0.54
▸ MEN1 O00255 2/20 0.49
▸ RGS12 O14924 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ ATM Q13315 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ TLR9 Q9NR96 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ RAB9A P51151 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47

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
SCHEMBL10003923 0.97 STAT3 (0.58) STAT3HIF1ATERTMEN1RGS12
SCHEMBL11923437 0.94 STAT3 (0.56) STAT3HIF1ATERTMEN1RGS12
SCHEMBL10004510 0.94 STAT3 (0.56) STAT3HIF1ATERTMEN1RGS12
SCHEMBL11923436 0.94 STAT3 (0.56) STAT3HIF1ATERTMEN1RGS12
SCHEMBL11923433 0.93 STAT3 (0.55) STAT3HIF1ATERTMEN1RGS12
SCHEMBL14650597 0.93 STAT3 (0.57) STAT3HIF1ATERTMEN1RGS12
SCHEMBL4812097 0.91 STAT3 (0.69) STAT3HIF1ATERTMEN1RGS12
SCHEMBL18306963 0.90 STAT3 (0.57) STAT3HIF1ATERTMEN1RGS12
SCHEMBL17080783 0.90 STAT3 (0.51) STAT3HIF1ATERTMEN1RGS12
SCHEMBL26997877 0.88 STAT3 (0.50) STAT3HIF1ATERTMEN1RGS12

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 3 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-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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