SCHEMBL11280245

SCHEMBL11280245

Nc1cnn(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(=O)c1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 4/20 0.51
MCHR1 Q99705 3/20 0.51
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
JUN P05412 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
ACHE P22303 1/20 0.39
KMT2A Q03164 4/20 0.39
MAPT P10636 3/20 0.39
HPGD P15428 2/20 0.39
MEN1 O00255 2/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
PAX8 Q06710 3/20 0.39
HTT P42858 3/20 0.39
S1PR4 O95977 2/20 0.39
ALDH1A1 P00352 2/20 0.39
S1PR1 P21453 2/20 0.39

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
SCHEMBL29776941 0.86 NPC1 (0.56) NPBWR1MCHR1NPC1RAB9AKMT2A
SCHEMBL11277555 0.85 NPBWR1 (0.60) NPBWR1MCHR1NPC1RAB9AJUN
SCHEMBL11730032 0.80 NPBWR1 (0.52) NPBWR1MCHR1NPC1RAB9AJUN
SCHEMBL17074612 0.79 RAB9A (0.59) NPBWR1MCHR1NPC1RAB9AJUN
Norflurazone SCHEMBL10870860 0.75 CYP1A2 (0.64) NPBWR1MCHR1NPC1RAB9AKMT2A
SCHEMBL17074605 0.74 CNR2 (0.70) NPBWR1MCHR1NPC1RAB9AKMT2A
Pyrazon SCHEMBL1858918 0.73 RAB9A (0.70) NPC1RAB9AKMT2AMAPTHPGD
Pyrazon SCHEMBL53824 0.73 RAB9A (0.70) NPC1RAB9AKMT2AMAPTHPGD
Pyrazon SCHEMBL7584298 0.72 SMN1; SMN2 (0.42) NPC1RAB9AACHEKMT2AMAPT
SCHEMBL17074607 0.72 CNR2 (0.54) NPBWR1MCHR1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4366155-A 1-Benzoyl-3-(6-oxopyridazinyl)ureas, compositions, and insecticidal method ELI LILLY AND COMPANY (US) 1982-12-28 US disclosed
EP-0063413-A1 1-Benzoyl-3-(heterocyclic)ureas, compositions, and insecticidal method ELI LILLY AND COMPANY (US) 1982-10-27 EP disclosed