SCHEMBL7318943

SCHEMBL7318943

Cc1[nH]c(=O)ccc1-c1ccccc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.49
KDM4E B2RXH2 3/20 0.49
HSD17B10 Q99714 2/20 0.49
BRD4 O60885 1/20 0.43
MAOA P21397 2/20 0.39
MAOB P27338 1/20 0.39
GUSB P08236 1/20 0.38
ALDH1A1 P00352 3/20 0.38
BCL2L1 Q07817 1/20 0.38
KDR P35968 1/20 0.37
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
PTPN1 P18031 1/20 0.37
ELANE P08246 2/20 0.37
CTSG P08311 1/20 0.37
MAPT P10636 3/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 2/20 0.36

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
SCHEMBL11010732 0.75 PDE4A (0.53) HPGDKDM4EHSD17B10ALDH1A1GAA
SCHEMBL10891718 0.71 APP (0.46) GUSBMGAMGAASIMGAM2
SCHEMBL7331775 0.70 MAOA (0.43) MAOAMAOBMGAMGAASI
SCHEMBL30442890 0.69 ALDH1A1 (0.67) HPGDKDM4EHSD17B10MAOAALDH1A1
SCHEMBL29623192 0.69 ALDH1A1 (0.67) HPGDKDM4EHSD17B10MAOAALDH1A1
SCHEMBL28574 0.69 ALDH1A1 (0.67) HPGDKDM4EHSD17B10MAOAALDH1A1
SCHEMBL27659427 0.69 ALDH1A1 (0.67) HPGDKDM4EHSD17B10MAOAALDH1A1
SCHEMBL7319990 0.69 KDM4E (0.67) HPGDKDM4EHSD17B10BRD4ALDH1A1
SCHEMBL10843649 0.69 PDE3B (0.42) BRD4ALDH1A1TDP2NSD2TDP1
SCHEMBL10823691 0.68 CASP3 (0.63) HPGDKDM4EHSD17B10ALDH1A1BCL2L1

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
US-5153209-A Cardiotonic agents GLAXO INC. (US) 1992-10-06 US disclosed
US-5051431-A For treatment of congestive heart failure GLAXO INC. (US) 1991-09-24 US disclosed
EP-0419286-A2 Pyridone nitriles useful in treating cardiovascular disease GLAXO WELLCOME INC. (US) 1991-03-27 EP disclosed