SCHEMBL14650604

SCHEMBL14650604

CC(COCC(C)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCc1ccc(Cl)cc1)C5=O)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCc1ccc(Cl)cc1)C5=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 6/20 0.42
▸ STAT3 P40763 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ CA1 P00915 3/20 0.39
▸ CA2 P00918 3/20 0.39
▸ CA9 Q16790 3/20 0.39
▸ CA12 O43570 2/20 0.39
▸ MAPT P10636 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ GAA P10253 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ UBE2N P61088 1/20 0.38
▸ CYP1B1 Q16678 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL14650602 0.89 TERT (0.42) TERTSTAT3HIF1ACA1CA2
SCHEMBL14650630 0.89 CYP1B1 (0.49) TERTSTAT3HIF1ACA1CA2
SCHEMBL14650599 0.88 GSK3A (0.45) TERTSTAT3HIF1ACA1CA2
SCHEMBL14650616 0.85 ACHE (0.41) TERTSTAT3HIF1AMAPTLMNA
SCHEMBL14650533 0.85 TERT (0.34) TERTSTAT3HIF1ACA1CA2
SCHEMBL31257229 0.84 TERT (0.53) TERTSTAT3HIF1ACA1CA2
SCHEMBL14303166 0.84 TERT (0.53) TERTSTAT3HIF1ACA1CA2
SCHEMBL14650596 0.84 LMNA (0.52) MAPTPOLBLMNAMAPK1ALDH1A1
SCHEMBL14650611 0.81 CYP1B1 (0.52) TERTSTAT3HIF1AMAPTPOLB
SCHEMBL14650588 0.80 STAT3 (0.51) TERTSTAT3HIF1AMAPTPOLB

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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