SCHEMBL9734801

SCHEMBL9734801

O=C(O)CCC(=O)c1ccc(-c2ccc(Cl)cc2)o1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 2/20 0.67
FEN1 P39748 2/20 0.67
ALDH1A1 P00352 3/20 0.61
HPGD P15428 3/20 0.61
KDM4E B2RXH2 2/20 0.61
MAPT P10636 1/20 0.61
PKM P14618 1/20 0.61
HTT P42858 1/20 0.61
GFER P55789 1/20 0.61
SLC9A1 P19634 1/20 0.52
LMNA P02545 1/20 0.52
PTPN1 P18031 1/20 0.49
ALOX12 P18054 1/20 0.48
SCN5A Q14524 1/20 0.48
SCN2A Q99250 1/20 0.48
SCN10A Q9Y5Y9 1/20 0.48
RECQL P46063 1/20 0.47
PDE4B Q07343 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL11635865 0.84 ALDH1A1 (0.61) ERCC5FEN1ALDH1A1HPGDKDM4E
SCHEMBL11631702 0.84 ALDH1A1 (0.55) ERCC5FEN1ALDH1A1HPGDKDM4E
SCHEMBL11725703 0.84 ERCC5 (0.62) ERCC5FEN1ALDH1A1HPGDKDM4E
SCHEMBL11635009 0.84 KDM4E (0.52) ERCC5FEN1ALDH1A1HPGDKDM4E
SCHEMBL11634177 0.82 SLC9A1 (0.56) ERCC5FEN1ALDH1A1HPGDKDM4E
SCHEMBL11805242 0.82 ERCC5 (0.68) ERCC5FEN1ALDH1A1HPGDKDM4E
SCHEMBL1286218 0.80 ALDH1A1 (0.70) ERCC5FEN1ALDH1A1HPGDKDM4E
Hydrochloric Acid SCHEMBL9478421 0.80 ERCC5 (0.57) ERCC5FEN1ALDH1A1HPGDKDM4E
SCHEMBL9478990 0.78 ERCC5 (0.71) ERCC5FEN1ALDH1A1HPGDKDM4E
SCHEMBL11826852 0.78 ALDH1A1 (0.63) ERCC5FEN1ALDH1A1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4035394-A 5-Phenyl-2-furanyl-oxo or-hydroxy alkanoic acids and ethyl esters as gastric acid antisecretory agents MORTON-NORWICH PRODUCTS, INC. (US) 1977-07-12 US claimed
US-5091426-A 5-PHENYL-2-FURAN KETONES AND USE AS ANTIEPILEPTIC AGENTS NORWICH EATON PHARMACEUTICALS, INC. (US) 1992-02-25 US disclosed
EP-0404232-A1 The use of 5-phenyl-2-furan ketones as antiepileptic agents Norwich Eaton Pharmaceuticals, Inc. (US) 1990-12-27 EP disclosed
US-4035394-A 5-Phenyl-2-furanyl-oxo or-hydroxy alkanoic acids and ethyl esters as gastric acid antisecretory agents MORTON-NORWICH PRODUCTS, INC. (US) 1977-07-12 US disclosed