SCHEMBL9737735

SCHEMBL9737735

CC(=O)c1ccc2c(c1)C(n1ccccc1=O)=C(CO)C(C)(C)O2

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 1/20 0.35
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
PKM P14618 1/20 0.31
ITGB1 P05556 1/20 0.31
ITGA4 P13612 1/20 0.31
BAZ2B Q9UIF8 2/20 0.31
BAZ2A Q9UIF9 2/20 0.31
BRD4 O60885 1/20 0.31
BRD9 Q9H8M2 1/20 0.31
FGFR1 P11362 1/20 0.31
F10 P00742 1/20 0.31
SYK P43405 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
ELOVL6 Q9H5J4 1/20 0.30

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
SCHEMBL9738703 0.89 CNR2 (0.38) ALDH1A1SMN1; SMN2FGFR1NPC1RAB9A
SCHEMBL9733560 0.87 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2F10NPC1RAB9A
SCHEMBL8088434 0.86 S100A4 (0.37) S100A4KDM4EALDH1A1SMN1; SMN2NR1H2
SCHEMBL9733518 0.85 FTO (0.31) SMN1; SMN2
SCHEMBL9147909 0.85 NR1H4 (0.33) KDM4EF10
SCHEMBL9733395 0.83 S100A4 (0.35) S100A4KDM4ENR1H2NR1H3FGFR1
SCHEMBL9369702 0.82 ABCC9 (0.35) F10
SCHEMBL9732962 0.82 MAPT (0.35) S100A4ALDH1A1SMN1; SMN2NR1H2NR1H3
SCHEMBL9734520 0.81
SCHEMBL8076894 0.77 KMT2A (0.36) KDM4EALDH1A1NR1H2NR1H3F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5143924-A OXODIHYDROPYRIDYL CHROMAN DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-09-01 US disclosed