SCHEMBL9828077

SCHEMBL9828077

COCCOc1ccc(CSc2cnn(C(C)(C)C)c(=O)c2Cl)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.67
RAB9A P51151 2/20 0.67
MEN1 O00255 1/20 0.67
GALR3 O60755 1/20 0.67
NR2F2 P24468 1/20 0.67
GPR183 P32249 1/20 0.67
KMT2A Q03164 1/20 0.67
GPR35 Q9HC97 1/20 0.67
GAA P10253 2/20 0.46
MAPT P10636 2/20 0.46
PKM P14618 1/20 0.46
SMN1; SMN2 Q16637 7/20 0.40
LMNA P02545 4/20 0.40
CACNA1H O95180 1/20 0.38
HPGD P15428 2/20 0.37
HTT P42858 2/20 0.37
ATM Q13315 1/20 0.37
DAO P14920 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL9830508 0.90 MEN1 (0.69) NPC1RAB9AMEN1GALR3NR2F2
SCHEMBL9775144 0.90 RAB9A (0.69) NPC1RAB9AMEN1GALR3NR2F2
SCHEMBL9775159 0.88 NPC1 (0.66) NPC1RAB9AMEN1GALR3NR2F2
SCHEMBL9775230 0.88 MEN1 (0.71) NPC1RAB9AMEN1GALR3NR2F2
SCHEMBL9775171 0.88 NPC1 (0.65) NPC1RAB9AMEN1GALR3NR2F2
SCHEMBL9775195 0.88 NPC1 (0.65) NPC1RAB9AMEN1GALR3NR2F2
SCHEMBL9827883 0.85 RAB9A (0.64) NPC1RAB9AMEN1GALR3NR2F2
SCHEMBL9237162 0.84 NPC1 (0.66) NPC1RAB9AMEN1GALR3NR2F2
SCHEMBL9775209 0.84 MEN1 (0.66) NPC1RAB9AMEN1GALR3NR2F2
SCHEMBL10639218 0.83 MEN1 (0.65) NPC1RAB9AMEN1GALR3NR2F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0199281-B1 PYRIDAZINONE DERIVATIVES, PREPARATION THEREOF, AND INSECTICIDAL, ACARICIDAL, NEMATICIDAL, FUNGICIDAL COMPOSITIONS NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1991-07-10 EP disclosed
US-4837217-A Pyridazinone derivatives, preparation thereof, and insecticidal, acaricidal, nematicidal, fungicidal compositions NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1989-06-06 US disclosed
CN-86102700-A The preparation method of pyridazinone derivative and desinsection thereof, kill mite, nematicide, fungicide composition 1986-12-17 CN disclosed