SCHEMBL14650616

SCHEMBL14650616

CC(COCC(C)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCc1ccc(Cl)cc1Cl)C5=O)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCc1ccc(Cl)cc1Cl)C5=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.41
▸ TERT O14746 6/20 0.39
▸ STAT3 P40763 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ DAO P14920 1/20 0.35
▸ MAPK1 P28482 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ TSHR P16473 1/20 0.34
▸ PDE10A Q9Y233 2/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ MAOB P27338 2/20 0.32
▸ MAOA P21397 1/20 0.32
▸ TNNI3 P19429 1/20 0.32
▸ TNNT2 P45379 1/20 0.32
▸ TNNC1 P63316 1/20 0.32

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
SCHEMBL14650524 0.86 MAPK1 (0.33) ACHETERTSTAT3HIF1AMAPK1
SCHEMBL14650604 0.85 TERT (0.42) TERTSTAT3HIF1AMAPK1MAPT
SCHEMBL14650630 0.78 CYP1B1 (0.49) TERTSTAT3HIF1AMAPTALDH1A1
SCHEMBL14650588 0.77 STAT3 (0.51) ACHETERTSTAT3HIF1AMAPK1
SCHEMBL14650602 0.77 TERT (0.42) TERTSTAT3HIF1AMAPTALDH1A1
SCHEMBL14650596 0.76 LMNA (0.52) MAPK1MAPTALDH1A1LMNASMN1; SMN2
SCHEMBL14650599 0.76 GSK3A (0.45) TERTSTAT3HIF1AMAPK1MAPT
SCHEMBL14650601 0.75 STAT3 (0.49) TERTSTAT3HIF1AALDH1A1MEN1
SCHEMBL14650611 0.74 CYP1B1 (0.52) TERTSTAT3HIF1AMAPTALDH1A1
SCHEMBL14650641 0.74 TDP1 (0.48) TERTSTAT3HIF1AMAPK1MAPT

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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