SCHEMBL9705393

SCHEMBL9705393

CCc1[nH]c(=O)oc1-c1ccc(OC)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
EGFR P00533 1/20 0.42
TGFBR1 P36897 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.41
MAP2K1 Q02750 1/20 0.41
KDM4E B2RXH2 4/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 3/20 0.40
CYP3A4 P08684 2/20 0.40
HSD17B10 Q99714 2/20 0.40
MAPT P10636 2/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
CASP1 P29466 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
SCHEMBL3099432 0.79 NOTUM (0.49) NOTUMMEN1KMT2AEGFRABCG2
SCHEMBL9710552 0.70 ADH5 (0.52) MEN1KMT2ACYP3A4
SCHEMBL11199895 0.70 MAP2K1 (0.49) MEN1KMT2ATGFBR1MAP2K1KDM4E
SCHEMBL6538871 0.69 MAOB (0.47) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL10994404 0.66 PARP1 (0.45) MEN1KMT2ATGFBR1KDM4ENPC1
SCHEMBL17260662 0.66 PDE3B (0.63) NOTUMMEN1KMT2AEGFRKDM4E
SCHEMBL17260649 0.66 PDE3B (0.63) NOTUMMEN1KMT2AEGFRKDM4E
SCHEMBL8846 0.66 PDE3B (0.46) KDM4ENPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6603063 0.65 MAP2K1 (0.54) NOTUMMEN1KMT2AEGFRMAP2K1
SCHEMBL9201010 0.65 MEN1 (0.61) MEN1KMT2AESR1ESR2EGFR

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
EP-0223177-B1 CARDIOTONIC PHENYL OXAZOLONES MERRELL DOW PHARMACEUTICALS INC. (US) 1992-08-19 EP disclosed