SCHEMBL28019223

SCHEMBL28019223

NNN(C(=O)N(NN)c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.50
TDP1 Q9NUW8 4/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 4/20 0.42
TSHR P16473 2/20 0.42
GLA P06280 1/20 0.42
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
MITF O75030 1/20 0.39
PAX8 Q06710 1/20 0.39
POLB P06746 2/20 0.38
HTT P42858 2/20 0.38
PTGES O14684 1/20 0.38
CTSD P07339 1/20 0.38
NPC1 O15118 1/20 0.38
ATM Q13315 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36

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
SCHEMBL5624200 0.86 TDP1 (0.46) NPSR1TDP1L3MBTL1RAB9ASMN1; SMN2
SCHEMBL7417080 0.84 TDP1 (0.44) NPSR1TDP1L3MBTL1RAB9ASMN1; SMN2
SCHEMBL28304379 0.81 TDP1 (0.65) NPSR1TDP1L3MBTL1RAB9ASMN1; SMN2
SCHEMBL28019220 0.80 TDP1 (0.50) NPSR1TDP1L3MBTL1RAB9ASMN1; SMN2
SCHEMBL7472041 0.79 ALDH1A1 (0.51) NPSR1TDP1L3MBTL1RAB9ASMN1; SMN2
SCHEMBL28013534 0.77 SMN1; SMN2 (0.46) NPSR1TDP1L3MBTL1RAB9ASMN1; SMN2
SCHEMBL11150064 0.76 ALDH1A1 (0.56) NPSR1TDP1L3MBTL1RAB9ASMN1; SMN2
SCHEMBL10419654 0.71 TDP1 (0.44) NPSR1TDP1L3MBTL1RAB9ASMN1; SMN2
SCHEMBL5622596 0.70 TDP1 (0.52) NPSR1TDP1L3MBTL1RAB9ASMN1; SMN2
SCHEMBL11366683 0.70 ALDH1A1 (0.48) TDP1L3MBTL1RAB9AALDH1A1TSHR

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
CN-104610142-A 3-bishydrazide diphenylurea derivative, and preparation method and application of 3-bishydrazide diphenylurea derivative UNIV QINGDAO AGRICULTURAL 2015-05-13 CN disclosed