SCHEMBL8656369

SCHEMBL8656369

O=C(O)CCCCCNC(=O)c1ccc(O)c(O)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.73
POLB P06746 3/20 0.63
KDM4E B2RXH2 2/20 0.62
ALDH1A1 P00352 2/20 0.62
LMNA P02545 1/20 0.62
CYP1A2 P05177 1/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
HPGD P15428 1/20 0.57
FABP4 P15090 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.53
HDAC6 Q9UBN7 2/20 0.51
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51

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
SCHEMBL18619400 0.91 HDAC6 (0.58) MAPK1KDM4ESMN1; SMN2HDAC6HDAC3
SCHEMBL3187483 0.87 SIRT5 (0.58) MAPK1POLBKDM4EALDH1A1CA1
SCHEMBL13593309 0.87 MAPK1 (0.68) MAPK1POLBKDM4EALDH1A1LMNA
SCHEMBL29633482 0.85 HDAC6 (0.60) POLBKDM4EALDH1A1CA1CA2
SCHEMBL24440484 0.85 HDAC6 (0.60) POLBKDM4EALDH1A1CA1CA2
SCHEMBL428355 0.85 MAPK1 (1.00) MAPK1POLBKDM4EALDH1A1LMNA
SCHEMBL11089138 0.84 POLB (0.56) MAPK1POLBKDM4EALDH1A1HPGD
SCHEMBL8654966 0.84 POLB (0.81) MAPK1POLBKDM4EALDH1A1LMNA
SCHEMBL28134814 0.84 POLB (0.81) MAPK1POLBKDM4EALDH1A1LMNA
SCHEMBL15985477 0.83 XDH (0.51) MAPK1POLBKDM4ECA2SMN1; 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0059108-B1 DERIVATIVES OF DIHYDROXYBENZOIC ACID KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-08-14 EP claimed
EP-0059108-A1 Derivatives of dihydroxybenzoic acid KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1982-09-01 EP claimed
US-5854250-A N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process of preparing same GYOGYSZERKUTATO INTEZET KFT (HU) 1998-12-29 US disclosed
US-5705529-A ANTIISCHEMIC AGENTS, ANTIINFLAMMATORY AGENTS, AGING RESISTANCE, ATHERIOSCLEROSIS, NERVOUS SYSTEM DISORDERS GYOGYSZERKUTATO INTEZET KFT (HK) 1998-01-06 US disclosed
EP-0576941-B1 N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process for preparing same NISSHIN FLOUR MILLING CO (JP) 1997-09-03 EP disclosed
EP-0576941-A1 N-benzoylamino acid derivatives, pharmaceutical compositions containing them and process for preparing same NISSHIN FLOUR MILLING CO., LTD. (JP) 1994-01-05 EP disclosed
EP-0059108-B1 DERIVATIVES OF DIHYDROXYBENZOIC ACID KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-08-14 EP disclosed
US-4409240-A ANTICOAGULANTS, ANTIINFLAMMATORY AGENTS, HYPOTENSIVE AGENTS, BRONCHODILATOR, AND ANTIARTHRITIC AGENTS KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1983-10-11 US disclosed
EP-0059108-A1 Derivatives of dihydroxybenzoic acid KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1982-09-01 EP disclosed