SCHEMBL6890145

SCHEMBL6890145

CCC(=O)CC(=O)c1ccc(O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 8/20 0.59
PTPN1 P18031 1/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
ALDH1A1 P00352 3/20 0.50
ESR1 P03372 3/20 0.50
ESR2 Q92731 3/20 0.50
CYP3A4 P08684 2/20 0.50
HIF1A Q16665 2/20 0.50
BLM P54132 2/20 0.50
MEN1 O00255 1/20 0.50
NR1I2 O75469 1/20 0.50
USP2 O75604 1/20 0.50
LMNA P02545 1/20 0.50
NR3C1 P04150 1/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
FYN P06241 1/20 0.50
PGR P06401 1/20 0.50
CHRM2 P08172 1/20 0.50

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
SCHEMBL9483307 0.91 MAPT (0.48) HSD17B3PTPN1NPC1RAB9AALDH1A1
SCHEMBL8237426 0.83 KMT2A (0.62) NPC1RAB9AALDH1A1MEN1LMNA
Paroxypropione SCHEMBL440470 0.82 HSD17B3 (0.68) HSD17B3PTPN1NPC1RAB9AALDH1A1
SCHEMBL3987484 0.82 NPC1 (0.65) HSD17B3PTPN1NPC1RAB9AALDH1A1
SCHEMBL12580910 0.82 ALDH1A1 (0.55) NPC1RAB9AALDH1A1MEN1LMNA
SCHEMBL21202169 0.82 GSK3B (0.55) NPC1RAB9AALDH1A1MEN1LMNA
SCHEMBL6604902 0.82 HTR7 (0.56) PTPN1NPC1RAB9AALDH1A1MEN1
SCHEMBL433486 0.81 HSD17B3 (0.73) HSD17B3PTPN1NPC1RAB9AALDH1A1
SCHEMBL2059932 0.81 KMT2A (0.67) PTPN1NPC1RAB9AALDH1A1CYP3A4
SCHEMBL27800112 0.81 BLM (0.57) HSD17B3PTPN1NPC1RAB9AALDH1A1

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-0900831-B1 Ink composition capable of realizing image possessing excellent storage stability SEIKO EPSON CORP (JP) 2004-07-14 EP disclosed
US-6653367-B2 Using thermoplastic resin SEIKO EPSON CORPORATION (JP) 2003-11-25 US disclosed
US-20010023266-A1 Ink composition capable of realizing image possessing excellent rubbing/scratch resistance SEIKO EPSON CORPORATION 2001-09-20 US disclosed
US-6204307-B1 FINE PARTICLES OF A POLYMER HAVING A LIGAND STRUCTURE THAT COMBINES WITH A METAL ION TO FORM A CHELATE AND, UPON THE FORMATION OF THE CHELATE, FORMS AN AGGLOMERATE. SEIKO EPSON CORPORATION (JP) 2001-03-20 US disclosed
EP-0900831-A2 Ink composition capable of realizing image possessing excellent rubbing/scratch resistance SEIKO EPSON CORPORATION (JP) 1999-03-10 EP disclosed