SCHEMBL11449286

SCHEMBL11449286

O=C(NO)N(Cl)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.43
HDAC8 Q9BY41 5/20 0.41
HDAC6 Q9UBN7 5/20 0.41
HDAC1 Q13547 4/20 0.41
HDAC3 O15379 3/20 0.41
HDAC2 Q92769 3/20 0.41
HDAC7 Q8WUI4 2/20 0.41
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
IDO1 P14902 1/20 0.41
CA9 Q16790 1/20 0.41
NCOR2 Q9Y618 1/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 3/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
POLB P06746 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL2068767 0.83 NPSR1 (0.43) NPSR1ALOX15HSD17B10KMT2AALDH1A1
SCHEMBL27750464 0.81 LMNA (0.42) NPSR1ALOX15HSD17B10KMT2AALDH1A1
SCHEMBL4359332 0.79 MEN1 (0.56) NPSR1ALOX15HSD17B10KMT2AALDH1A1
SCHEMBL1563099 0.77 NPSR1 (0.58) NPSR1HDAC8HDAC6HDAC1HDAC3
SCHEMBL11115139 0.77 NPSR1 (0.56) NPSR1ALOX15KMT2AALDH1A1RAB9A
SCHEMBL3730131 0.77 NPSR1 (0.50) NPSR1ALOX15CA12CA9KMT2A
SCHEMBL28809670 0.76 NPSR1 (0.38) NPSR1ALOX15HSD17B10KMT2AALDH1A1
SCHEMBL28644895 0.76 ALDH1A1 (0.40) NPSR1ALOX15HSD17B10KMT2AALDH1A1
SCHEMBL27666370 0.76 NPSR1 (0.38) NPSR1ALOX15HSD17B10KMT2AALDH1A1
SCHEMBL2913044 0.76 TDP1 (0.47) NPSR1HDAC8HDAC6HDAC1HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-55015446-A None JP disclosed
JP-S5515446-A PREPARATION OF N-CHLOROPHENYL-N'-METHOXY-N'-METHYLUREA NIPPON KAYAKU CO LTD 1980-02-02 JP disclosed