SCHEMBL14219924

SCHEMBL14219924

CC(=O)OCCCc1cc(Cc2cc(CCCOC(C)=O)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSPA5 P11021 2/20 0.54
▸ TNKS2 Q9H2K2 1/20 0.51
▸ HIF1A Q16665 4/20 0.44
▸ CYP2C9 P11712 3/20 0.44
▸ CYP2C19 P33261 3/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ GAA P10253 6/20 0.43
▸ CYP2D6 P10635 2/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ KMT2A Q03164 4/20 0.39
▸ ALDH1A1 P00352 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ TSHR P16473 3/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ BLM P54132 2/20 0.36
▸ ATM Q13315 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ USP2 O75604 1/20 0.36

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
SCHEMBL14003041 0.96 HSPA5 (0.52) HSPA5TNKS2HIF1ACYP2C9CYP2C19
SCHEMBL14003040 0.95 TNKS2 (0.50) HSPA5TNKS2HIF1ACYP2C9CYP2C19
SCHEMBL14003023 0.94 HSPA5 (0.48) HSPA5TNKS2HIF1ACYP2C9CYP2C19
SCHEMBL14003035 0.88 TNKS2 (0.48) HSPA5TNKS2HIF1ACYP2C9CYP2C19
SCHEMBL14003021 0.87 HSPA5 (0.55) HSPA5TNKS2HIF1ACYP2C9CYP2C19
SCHEMBL14581971 0.86 HSPA5 (0.54) HSPA5TNKS2HIF1ACYP2C9CYP2C19
SCHEMBL14003030 0.86 HSPA5 (0.50) HSPA5TNKS2HIF1ACYP2C9CYP2C19
SCHEMBL13899740 0.85 TNKS2 (0.44) HSPA5TNKS2HIF1ACYP2C9CYP2C19
SCHEMBL14581967 0.84 HSPA5 (0.51) HSPA5TNKS2HIF1ACYP2C9CYP2C19
SCHEMBL14581970 0.83 HSPA5 (0.59) HSPA5HIF1ACYP2C9CYP2C19SMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1909139-A1 Copolymer and photothermographic material containing the same Konica Minolta Medical & Graphic, Inc. (JP) 2008-04-09 — — EP disclosed
US-20070212656-A1 PHOTOTHERMOGRAPHIC MATERIAL KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-09-13 — — US disclosed
US-20070212656-A1 PHOTOTHERMOGRAPHIC MATERIAL KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-09-13 — — US disclosed
US-20070037103-A1 BISPHENOL COMPOUND AND PHOTOTHERMOGRAPHIC MATERIAL KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-02-15 — — US disclosed
US-20070037103-A1 BISPHENOL COMPOUND AND PHOTOTHERMOGRAPHIC MATERIAL KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-02-15 — — US disclosed
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