SCHEMBL17028035

SCHEMBL17028035

CC(=O)N(O)N(C(=O)Nc1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.53
HSD17B10 Q99714 3/20 0.48
NAPRT Q6XQN6 1/20 0.48
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 2/20 0.47
ALOX15 P16050 1/20 0.47
HTT P42858 1/20 0.46
TAAR1 Q96RJ0 2/20 0.45
MTOR P42345 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
POLB P06746 1/20 0.43
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.42
EPHX1 P07099 1/20 0.42
TSHR P16473 1/20 0.42
EPHX2 P34913 1/20 0.42

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
SCHEMBL30879612 0.84 MEN1 (0.59) KMT2AMEN1HSD17B10NAPRTNPC1
SCHEMBL8517158 0.74 HSD17B10 (0.77) KMT2AMEN1HSD17B10NAPRTNPC1
SCHEMBL2512409 0.73 MLYCD (0.65) KMT2AMEN1HSD17B10NAPRTNPC1
SCHEMBL10791571 0.72 MEN1 (0.59) KMT2AMEN1HSD17B10NAPRTNPC1
SCHEMBL7613102 0.72 MTOR (0.58) KMT2AMEN1HSD17B10NAPRTNPC1
SCHEMBL1382899 0.72 MEN1 (0.67) KMT2AMEN1HSD17B10NAPRTNPC1
SCHEMBL11231678 0.72 HSD17B10 (0.55) KMT2AMEN1HSD17B10NAPRTNPC1
SCHEMBL27342484 0.71 NPSR1 (0.50) KMT2AMEN1HSD17B10NAPRTNPC1
SCHEMBL5974531 0.71 MAPT (0.58) KMT2AMEN1HSD17B10NAPRTNPC1
SCHEMBL5974527 0.71 MAPT (0.58) KMT2AMEN1NPC1RAB9AMAPT

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
WO-2015126930-A2 BOOSTER DRUG THERAPY FOR MYCOBACTERIUM INFECTIONS STC.UNM (US) 2015-08-27 WO claimed