SCHEMBL27953145

SCHEMBL27953145

O=C(NCc1ccc(Cl)cc1)Nc1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.72
NPC1 O15118 7/20 0.72
POLB P06746 2/20 0.72
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
HPGD P15428 2/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
MAOB P27338 1/20 0.71
TP53 P04637 1/20 0.71
NAMPT P43490 1/20 0.68
ALOX12 P18054 1/20 0.67
LSS P48449 1/20 0.67
HTT P42858 1/20 0.67
ERCC1 P07992 1/20 0.64
ERCC4 Q92889 1/20 0.64
CA1 P00915 1/20 0.64
CA2 P00918 1/20 0.64
CNR1 P21554 2/20 0.63
MTOR P42345 1/20 0.62
EPHX2 P34913 1/20 0.61

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
SCHEMBL8177097 0.93 RAB9A (0.72) RAB9ANPC1POLBMEN1KMT2A
SCHEMBL26098750 0.88 RAB9A (0.66) RAB9ANPC1POLBMEN1KMT2A
SCHEMBL2831462 0.88 NPC1 (0.77) RAB9ANPC1POLBMEN1KMT2A
SCHEMBL23747545 0.87 RAB9A (0.73) RAB9ANPC1POLBMEN1KMT2A
SCHEMBL31274801 0.87 EPHX2 (0.66) RAB9ANPC1POLBMEN1KMT2A
SCHEMBL23747730 0.86 RORC (0.72) RAB9ANPC1POLBMEN1KMT2A
SCHEMBL19570474 0.86 RORC (0.72) RAB9ANPC1POLBMEN1KMT2A
SCHEMBL13479675 0.85 TP53 (0.73) RAB9ANPC1POLBMEN1KMT2A
SCHEMBL23727986 0.85 RAB9A (0.75) RAB9ANPC1POLBMEN1KMT2A
SCHEMBL23727642 0.85 RAB9A (0.75) RAB9ANPC1POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112574070-B Synthesis method of substituted urea compound 西华大学 2022-11-08 CN disclosed
CN-112574070-A Synthesis method of substituted urea compound 西华大学 2021-03-30 CN disclosed
CN-103664704-B A kind of synthetic N, the method for N '-disubstituted urea NANJING UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-05-18 CN disclosed
CN-103664704-A Method for synthesizing N,N'-disubstituent urea UNIV NANJING SCIENCE & TECH 2014-03-26 CN disclosed