SCHEMBL29556261

SCHEMBL29556261

O=C(Nc1cc(Cl)cc(Cl)c1)Nc1cccc(OC(F)(F)F)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 1/20 0.62
MAPT P10636 5/20 0.56
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
RAB9A P51151 4/20 0.56
NPSR1 Q6W5P4 2/20 0.56
EPHX2 P34913 2/20 0.56
HTT P42858 4/20 0.55
ALDH1A1 P00352 2/20 0.55
LMNA P02545 2/20 0.55
CNR1 P21554 1/20 0.54
GAA P10253 1/20 0.53
HPGD P15428 1/20 0.53
ALOX15 P16050 1/20 0.53
TSHR P16473 1/20 0.53
TP53 P04637 1/20 0.52
CASP3 P42574 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
NPC1 O15118 2/20 0.51
MCHR1 Q99705 1/20 0.50

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
SCHEMBL29555891 0.93 P2RX1 (0.67) P2RX1MAPTMEN1KMT2ARAB9A
SCHEMBL29556257 0.91 P2RX1 (0.56) P2RX1MAPTMEN1KMT2ARAB9A
SCHEMBL29555858 0.90 MEN1 (0.62) P2RX1MAPTMEN1KMT2ARAB9A
SCHEMBL29556142 0.90 MEN1 (0.62) P2RX1MAPTMEN1KMT2ARAB9A
SCHEMBL29556351 0.86 P2RX1 (0.56) P2RX1MAPTMEN1KMT2ANPSR1
SCHEMBL29556929 0.86 MAPT (0.50) P2RX1MAPTMEN1KMT2ARAB9A
SCHEMBL29557086 0.84 MEN1 (0.64) P2RX1MAPTMEN1KMT2ARAB9A
SCHEMBL29556278 0.83 MAPT (0.60) P2RX1MAPTMEN1KMT2ARAB9A
SCHEMBL11002886 0.83 MAPT (0.58) P2RX1MAPTMEN1KMT2ARAB9A
SCHEMBL29556410 0.83 MTOR (0.61) P2RX1MAPTMEN1KMT2ARAB9A

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