SCHEMBL9775159

SCHEMBL9775159

CCCCCOc1ccc(CSc2cnn(C(C)(C)C)c(=O)c2Cl)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.66
RAB9A P51151 7/20 0.66
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
GALR3 O60755 1/20 0.66
NR2F2 P24468 1/20 0.66
GPR183 P32249 1/20 0.66
GPR35 Q9HC97 1/20 0.66
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
LMNA P02545 5/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
KDM4E B2RXH2 2/20 0.41
HTT P42858 2/20 0.39
TSHR P16473 1/20 0.39
TP53 P04637 2/20 0.37
HPGD P15428 2/20 0.37
S1PR1 P21453 1/20 0.36
S1PR5 Q9H228 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
SCHEMBL9775171 0.99 NPC1 (0.65) NPC1RAB9AMEN1KMT2AGALR3
SCHEMBL9775195 0.99 NPC1 (0.65) NPC1RAB9AMEN1KMT2AGALR3
SCHEMBL9775144 0.94 RAB9A (0.69) NPC1RAB9AMEN1KMT2AGALR3
SCHEMBL9775230 0.89 MEN1 (0.71) NPC1RAB9AMEN1KMT2AGALR3
SCHEMBL9828077 0.88 NPC1 (0.67) NPC1RAB9AMEN1KMT2AGALR3
SCHEMBL12722375 0.87 MEN1 (0.71) NPC1RAB9AMEN1KMT2AGALR3
SCHEMBL9775191 0.86 MEN1 (0.70) NPC1RAB9AMEN1KMT2AGALR3
SCHEMBL9775175 0.86 MEN1 (0.70) NPC1RAB9AMEN1KMT2AGALR3
SCHEMBL9096210 0.86 MEN1 (0.70) NPC1RAB9AMEN1KMT2AGALR3
SCHEMBL21511091 0.86 MEN1 (0.73) NPC1RAB9AMEN1KMT2AGALR3

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
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-A1 Pyridazinone derivatives, preparation thereof and insecticidal, acaricidal, fungicidal compositions NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1985-03-20 EP disclosed