SCHEMBL14650658

SCHEMBL14650658

C=CS(=O)(=O)c1ccc2cc(N3C(=O)c4ccc5c6ccc7c8c(ccc(c9ccc(c4c59)C3=O)c86)C(=O)N(CCCOCCCN3C(=O)c4ccc5c6ccc8c9c(ccc(c%10ccc(c4c5%10)C3=O)c96)C(=O)N(c3ccc4cc(S(=O)(=O)C=C)ccc4c3)C8=O)C7=O)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ TERT O14746 8/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ CA12 O43570 4/20 0.36
▸ CA1 P00915 4/20 0.36
▸ CA2 P00918 4/20 0.36
▸ CA9 Q16790 4/20 0.36
▸ RAB9A P51151 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ RGS12 O14924 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ PABPC1 P11940 1/20 0.33

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
SCHEMBL14650656 0.91 CA1 (0.42) STAT3HIF1ATERTALDH1A1LMNA
SCHEMBL14650675 0.82 STAT3 (0.37) STAT3HIF1ATERTALDH1A1LMNA
SCHEMBL16784552 0.80 KDM4E (0.48) STAT3HIF1ATERTALDH1A1LMNA
SCHEMBL14650657 0.78 KDM4E (0.43) STAT3HIF1ATERTALDH1A1LMNA
SCHEMBL14650713 0.75 ALDH1A1 (0.34) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL14650563 0.74 ALDH1A1 (0.31) ALDH1A1LMNACYP1A2CYP2C9HPGD
SCHEMBL14650619 0.74 STAT3 (0.50) STAT3HIF1ATERTALDH1A1LMNA
SCHEMBL14650647 0.70 TERT (0.46) STAT3HIF1ATERTALDH1A1LMNA
SCHEMBL14650645 0.69 ALDH1A1 (0.40) STAT3HIF1ATERTALDH1A1LMNA
SCHEMBL14650624 0.69 STAT3 (0.58) STAT3HIF1ATERTALDH1A1LMNA

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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