SCHEMBL14650686

SCHEMBL14650686

CCC(COCC(C)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(c1ccc(S(=O)(=O)CCNCCCOCCCCO)cc1)C5=O)(COCC(C)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(c1ccc(S(=O)(=O)CCNCCCOCCCCO)cc1)C5=O)COCC(C)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(c1ccc(S(=O)(=O)CCNCCCOCCCCO)cc1)C5=O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL14650719 0.90 CA12 (0.32) NPSR1
SCHEMBL14650702 0.88 — —
SCHEMBL14650718 0.87 CA12 (0.35) NPSR1
SCHEMBL14650583 0.84 TERT (0.30) TERT
SCHEMBL14650693 0.82 CA12 (0.32) NPSR1
SCHEMBL14653895 0.81 TERT (0.43) TERTNPSR1
SCHEMBL14650647 0.81 TERT (0.46) TERT
SCHEMBL14650710 0.81 ALDH1A1 (0.33) —
SCHEMBL14650709 0.79 CA12 (0.31) —
SCHEMBL14650699 0.79 CA12 (0.32) NPSR1

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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