SCHEMBL7836895

SCHEMBL7836895

O=C1CN(c2ccccc2)C(=O)N1C(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
CTSG P08311 4/20 0.51
CMA1 P23946 4/20 0.51
MEN1 O00255 2/20 0.49
HPGD P15428 1/20 0.46
PGR P06401 4/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.42
F2 P00734 1/20 0.42
PLAU P00749 1/20 0.42
KLKB1 P03952 1/20 0.42
ELANE P08246 1/20 0.42
SMN1; SMN2 Q16637 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
SCHEMBL7838574 0.85 KMT2A (0.58) KMT2ANPC1RAB9ACTSGCMA1
SCHEMBL7826151 0.82 NPC1 (0.71) KMT2ANPC1RAB9ACTSGCMA1
SCHEMBL7837528 0.82 TSHR (0.53) KMT2ANPC1RAB9ACTSGCMA1
SCHEMBL7836516 0.80 KMT2A (0.60) KMT2ANPC1RAB9ACTSGCMA1
SCHEMBL7838341 0.79 CTSG (0.51) KMT2ANPC1RAB9ACTSGCMA1
SCHEMBL7837470 0.76 CTSG (0.53) KMT2ANPC1RAB9ACTSGCMA1
SCHEMBL7837364 0.76 KMT2A (0.55) KMT2ANPC1RAB9ACTSGCMA1
SCHEMBL7833371 0.75 CTSG (0.54) KMT2ANPC1RAB9ACTSGCMA1
SCHEMBL921684 0.71 NPC1 (0.51) KMT2ANPC1RAB9ACTSGCMA1
SCHEMBL10546674 0.71 KDM4E (0.49) KMT2ACTSGCMA1MEN1TSHR

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
EP-0721944-B1 IMIDAZOLIDINE DERIVATIVE AND USE THEREOF SUNTORY LTD (JP) 2001-01-17 EP disclosed
US-5691335-A CARDIOVASCULAR DISORDERS SUNTORY LIMITED (JP) 1997-11-25 US disclosed
EP-0721944-A1 IMIDAZOLIDINE DERIVATIVE AND USE THEREOF SUNTORY LIMITED (JP) 1996-07-17 EP disclosed