SCHEMBL7433887

SCHEMBL7433887

O=C(c1ccccc1O)n1ccoc1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.41
HPGD P15428 4/20 0.41
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
HMGB1 P09429 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
CA14 Q9ULX7 1/20 0.41
MAPT P10636 3/20 0.40
PTGS1 P23219 2/20 0.40
PTGS2 P35354 2/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 2/20 0.40
NPC1 O15118 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
SCHEMBL8009694 0.69 KDM4E (0.44) KDM4EHPGDALDH1A1SMN1; SMN2CA12
SCHEMBL27880869 0.69 KDM4E (0.52) KDM4EHPGDALDH1A1SMN1; SMN2CA12
SCHEMBL10431336 0.66 HPGD (0.54) KDM4EHPGDALDH1A1SMN1; SMN2CA12
SCHEMBL31347868 0.65 MEN1 (0.61) KDM4EHPGDALDH1A1SMN1; SMN2CA12
SCHEMBL11718417 0.65 MEN1 (0.61) KDM4EHPGDALDH1A1SMN1; SMN2CA12
SCHEMBL316802 0.64 KCNMA1 (0.46) KDM4EHPGDALDH1A1SMN1; SMN2CA12
SCHEMBL25131979 0.62 KDM4E (0.48) KDM4EHPGDALDH1A1SMN1; SMN2CA12
SCHEMBL1008405 0.62 MAPT (0.65) KDM4EHPGDALDH1A1SMN1; SMN2MAPT
SCHEMBL14511319 0.62 HTT (0.62) KDM4EHPGDALDH1A1SMN1; SMN2MAPT
SCHEMBL9797513 0.62 KDM4E (0.67) KDM4EHPGDALDH1A1SMN1; SMN2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0329070-B1 Cardiotonic alkanoyl and aroyl oxazolones MERRELL DOW PHARMA (US) 1994-01-05 EP disclosed
EP-0329070-A1 Cardiotonic alkanoyl and aroyl oxazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1989-08-23 EP disclosed