SCHEMBL29555591

SCHEMBL29555591

O=C(Nc1cc(Cl)cc(Cl)c1)Nc1cc(Br)cc(Br)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.61
KMT2A Q03164 6/20 0.61
MAPT P10636 6/20 0.61
RAB9A P51151 3/20 0.61
NPSR1 Q6W5P4 1/20 0.61
P2RY1 P47900 1/20 0.58
LMNA P02545 5/20 0.51
ALDH1A1 P00352 2/20 0.51
HTT P42858 2/20 0.50
DHODH Q02127 1/20 0.50
S1PR2 O95136 1/20 0.48
MAPK14 Q16539 2/20 0.46
NPC1 O15118 2/20 0.46
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
ACP1 P24666 1/20 0.44

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
SCHEMBL29556248 0.96 MAPT (0.61) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL29556074 0.96 MAPT (0.61) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL29555992 0.96 MEN1 (0.56) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL29555934 0.94 MEN1 (0.58) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL29555965 0.88 MEN1 (0.53) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL29556273 0.88 MEN1 (0.51) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL15786287 0.87 MEN1 (0.76) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL27193045 0.87 MAPK14 (0.54) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL29556382 0.84 MEN1 (0.51) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL29556215 0.84 MEN1 (0.67) MEN1KMT2AMAPTRAB9ANPSR1

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-2022078533-A1 SUBSTITUTED 1,3-DIPHENYLUREA DERIVATIVES AND 1-PHENYL-3-PYRIDYLUREA DERIVATIVES FOR PLANT BIOTECHNOLOGY, PREPARATIONS CONTAINING THESE COMPOUNDS AND USE THEREOF USTAV EXPERIMENTALNI BOTANIKY AV CR, V.V.I. (CZ) 2022-04-21 WO disclosed