SCHEMBL9867704

SCHEMBL9867704

O=C(Cc1ccc(-c2ccc(Cl)cc2)o1)Cc1ccc(-c2ccc(Cl)cc2)o1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.64
KDM4E B2RXH2 4/20 0.64
HPGD P15428 3/20 0.64
MAPT P10636 3/20 0.64
PKM P14618 3/20 0.64
HTT P42858 3/20 0.64
GFER P55789 1/20 0.64
NPSR1 Q6W5P4 2/20 0.62
ERCC5 P28715 1/20 0.49
FEN1 P39748 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
SLC9A1 P19634 1/20 0.46
LMNA P02545 1/20 0.46
RECQL P46063 1/20 0.45
RXFP1 Q9HBX9 2/20 0.44
HSD17B10 Q99714 2/20 0.44
TSHR P16473 1/20 0.44
PPARG P37231 1/20 0.44

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
SCHEMBL11452978 0.86 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDMAPTPKM
SCHEMBL7977954 0.79 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDMAPTPKM
SCHEMBL11621135 0.77 ALDH1A1 (0.65) ALDH1A1KDM4EHPGDMAPTPKM
SCHEMBL27990409 0.77 ALDH1A1 (0.75) ALDH1A1KDM4EHPGDMAPTPKM
SCHEMBL11504470 0.76 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDMAPTPKM
SCHEMBL11736792 0.76 ALDH1A1 (0.62) ALDH1A1KDM4EHPGDMAPTPKM
SCHEMBL5536394 0.76 ALDH1A1 (0.62) ALDH1A1KDM4EHPGDMAPTPKM
SCHEMBL2056342 0.76 ALDH1A1 (0.62) ALDH1A1KDM4EHPGDMAPTPKM
SCHEMBL11505498 0.76 CYP3A4 (0.66) ALDH1A1KDM4EHPGDMAPTPKM
SCHEMBL9867707 0.75 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDMAPTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3095172-A None JP disclosed
JP-H0395172-A USE OF 5-PHENYL-2-FRAN KETONE AS ANTIEPILEPTIC NORWICH EATON PHARMACEUT INC 1991-04-19 JP 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