SCHEMBL4873995

SCHEMBL4873995

CCCCc1ccc2c(C(=O)O)c(CCCC)c(C(=O)O)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT8 Q9H7Z6 2/20 0.48
PPARA Q07869 2/20 0.48
DHODH Q02127 2/20 0.45
PPARG P37231 1/20 0.45
RARB P10826 4/20 0.44
METAP2 P50579 1/20 0.43
AKR1C2 P52895 1/20 0.42
AKR1C1 Q04828 1/20 0.42
HPGD P15428 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 1/20 0.42
RARA P10276 1/20 0.41
RARG P13631 1/20 0.41
NPC1 O15118 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL7597467 0.96 KAT8 (0.53) KAT8PPARADHODHPPARGRARB
SCHEMBL7594955 0.95 KAT8 (0.56) KAT8PPARADHODHPPARGRARB
SCHEMBL7600185 0.95 KAT8 (0.56) KAT8PPARADHODHPPARGRARB
SCHEMBL7597489 0.95 KAT8 (0.56) KAT8PPARADHODHPPARGRARB
SCHEMBL4871678 0.89 LDHA (0.44) KAT8PPARADHODHPPARGMETAP2
SCHEMBL5348023 0.82 ACMSD (0.40) DHODHHPGDALDH1A1HSD17B10KDM4E
SCHEMBL7599562 0.80 ALDH1A1 (0.42) DHODHMETAP2AKR1C2HPGDALDH1A1
SCHEMBL8747693 0.80 POLB (0.56) KAT8PPARADHODHPPARGRARB
SCHEMBL4873999 0.78 KAT8 (0.45) KAT8PPARADHODHPPARGRARB
SCHEMBL11045723 0.77 GABRP (0.45) KAT8PPARAPPARGRARBAKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371455-B2 Laminates and packaging containers KYDO PRINTING CO., LTD. (JP) 2008-05-13 US disclosed
US-20060204695-A1 Laminates and packaging containers KYODO PRINTING CO., LTD. (JP) 2006-09-14 US disclosed
EP-0698631-B1 Ester copolymer resin, alloy thereof and packaging material using the same NIPPON KOKAN KK (JP) 2002-12-04 EP disclosed
US-5804267-A A BLEND OF POLYCARBONATE AND POLYESTER COPOLYMER; PACKAGING CONTAINER NKK CORPORATION (JP) 1998-09-08 US disclosed
US-5750219-A Ester copolymer resin, alloy thereof and packaging material using the same NKK CORPORATION (JP) 1998-05-12 US disclosed
EP-0698631-A2 Ester copolymer resin, alloy thereof and packaging material using the same NKK CORPORATION (JP) 1996-02-28 EP disclosed