SCHEMBL28014187

SCHEMBL28014187

Cc1ccccc1N(NN)C(=O)NC(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.44
HPGD P15428 2/20 0.44
POLB P06746 1/20 0.44
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP1A2 P05177 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TP53 P04637 1/20 0.39
CCR6 P51684 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL28019813 0.82 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2CYP1A2MEN1KMT2A
SCHEMBL27456060 0.78 EPHX1 (0.46) EPHX1HPGDPOLBALDH1A1SMN1; SMN2
SCHEMBL1620163 0.75 EPHX1 (0.43) EPHX1HPGDPOLBALDH1A1SMN1; SMN2
SCHEMBL28014188 0.73 HPGD (0.47) HPGDPOLBALDH1A1SMN1; SMN2CYP1A2
SCHEMBL28019225 0.72 ALDH1A1 (0.41) EPHX1ALDH1A1SMN1; SMN2CYP1A2MAPT
SCHEMBL27938805 0.71 ALDH1A1 (0.42) POLBALDH1A1MAPTKDM4EGAA
SCHEMBL28819013 0.70 NPC1 (0.48) HPGDALDH1A1MEN1KMT2ANPC1
SCHEMBL10691288 0.70 EPHX1 (0.45) EPHX1HPGDPOLBALDH1A1SMN1; SMN2
SCHEMBL8074109 0.70 ALDH1A1 (0.52) EPHX1ALDH1A1CYP1A2MEN1KMT2A
SCHEMBL28176461 0.67 ALDH1A1 (0.69) EPHX1HPGDPOLBALDH1A1SMN1; SMN2

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
CN-104592059-B 3-acylhydrazone diphenylurea derivative and its preparation method and application 青岛农业大学 2016-07-06 CN disclosed
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
CN-104592059-A 3-acylhydrazone diphenylurea derivatives as well as preparation method and applications thereof UNIV QINGDAO AGRICULTURAL 2015-05-06 CN disclosed