SCHEMBL9775193

SCHEMBL9775193

CC(C)(C)n1ncc(SCc2ccc(Cl)cc2)c(Cl)c1=O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.81
RAB9A P51151 2/20 0.81
KMT2A Q03164 2/20 0.81
MEN1 O00255 1/20 0.81
GALR3 O60755 1/20 0.81
NR2F2 P24468 1/20 0.81
GPR183 P32249 1/20 0.81
GPR35 Q9HC97 1/20 0.81
MAPT P10636 4/20 0.55
PKM P14618 3/20 0.55
GAA P10253 2/20 0.55
SMN1; SMN2 Q16637 7/20 0.42
LMNA P02545 6/20 0.42
HTT P42858 6/20 0.41
ALDH1A1 P00352 4/20 0.41
NPSR1 Q6W5P4 4/20 0.41
HPGD P15428 3/20 0.41
PPARG P37231 3/20 0.41
NCOA2 Q15596 3/20 0.41
NCOA1 Q15788 3/20 0.41

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
SCHEMBL9240139 0.92 KMT2A (0.70) NPC1RAB9AKMT2AMEN1GALR3
SCHEMBL9625863 0.90 KMT2A (0.67) NPC1RAB9AKMT2AMEN1GALR3
SCHEMBL9625865 0.90 KMT2A (0.67) NPC1RAB9AKMT2AMEN1GALR3
Pyridaben SCHEMBL8372466 0.90 MEN1 (1.00) NPC1RAB9AKMT2AMEN1GALR3
Pyridaben SCHEMBL27429 0.90 MEN1 (1.00) NPC1RAB9AKMT2AMEN1GALR3
SCHEMBL9234574 0.90 RAB9A (0.77) NPC1RAB9AKMT2AMEN1GALR3
SCHEMBL9775172 0.89 MEN1 (0.76) NPC1RAB9AKMT2AMEN1GALR3
SCHEMBL9238518 0.88 MEN1 (0.76) NPC1RAB9AKMT2AMEN1GALR3
SCHEMBL9775168 0.88 MEN1 (0.74) NPC1RAB9AKMT2AMEN1GALR3
SCHEMBL9240100 0.88 NPC1 (0.82) NPC1RAB9AKMT2AMEN1GALR3

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
US-5026850-A Pyridazinone derivatives, preparation thereof, and insecticidal, acaricidal, fungicidal compositions NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1991-06-25 US disclosed
US-4877787-A Benzylthio pyridazinone derivatives, preparation thereof, and insecticidal acaricidal, fungicidal compositions NISSAN CHEMICAL INDUSTRIES (JP) 1989-10-31 US disclosed
EP-0134439-B1 PYRIDAZINONE DERIVATIVES, PREPARATION THEREOF AND INSECTICIDAL, ACARICIDAL, FUNGICIDAL COMPOSITIONS NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1988-08-24 EP disclosed
EP-0134439-A1 Pyridazinone derivatives, preparation thereof and insecticidal, acaricidal, fungicidal compositions NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1985-03-20 EP disclosed