SCHEMBL9844351

SCHEMBL9844351

CCOC(=O)COc1ccc(C(=O)c2ccnn2CC)c(Cl)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
ALDH1A1 P00352 5/20 0.47
NPSR1 Q6W5P4 3/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.47
CASP1 P29466 1/20 0.47
HSD17B10 Q99714 1/20 0.47
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP2C9 P11712 2/20 0.39
HTT P42858 2/20 0.39
ABCC3 O15438 1/20 0.39
PLIN1 O60240 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL10709806 0.91 ALDH1A1 (0.44) MEN1KMT2AALDH1A1NPSR1HPGD
SCHEMBL9502467 0.88 MEN1 (0.52) MEN1KMT2AALDH1A1NPSR1HPGD
SCHEMBL9506410 0.80 ALDH1A1 (0.48) MEN1KMT2AALDH1A1NPSR1HPGD
SCHEMBL9745260 0.77 CYP2C9 (0.48) MEN1KMT2AALDH1A1NPSR1HPGD
SCHEMBL9503246 0.76 MEN1 (0.47) MEN1KMT2AALDH1A1NPSR1HPGD
SCHEMBL11141660 0.75 HPGD (0.52) MEN1KMT2AALDH1A1NPSR1HPGD
SCHEMBL9746104 0.74 L3MBTL1 (0.39) MEN1KMT2AALDH1A1NPSR1HPGD
SCHEMBL10660727 0.74 HPGD (0.51) MEN1KMT2AALDH1A1NPSR1HPGD
SCHEMBL9396069 0.74 ALDH1A1 (0.48) MEN1KMT2AALDH1A1NPSR1HPGD
SCHEMBL9393511 0.74 ALDH1A1 (0.48) MEN1KMT2AALDH1A1NPSR1HPGD

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-0414931-A1 Hypotensive agent TANABE SEIYAKU CO., LTD. (JP) 1991-03-06 EP disclosed