SCHEMBL8344868

SCHEMBL8344868

Cn1nc(-c2c(F)cccc2F)nc1Cc1ccc(O)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 12/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
HRH4 Q9H3N8 1/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
PIK3CD O00329 1/20 0.33
PIK3R1 P27986 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL8346582 0.91 KMT2A (0.36) METHDAC1HDAC6PSEN1PSEN2
SCHEMBL8342984 0.75 SMN1; SMN2 (0.36) ALDH1A1
SCHEMBL8343347 0.74 HCRTR1 (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL26766259 0.70 HRH4 (0.40) HRH4NPC1RAB9AALDH1A1
SCHEMBL8343159 0.69 PDE2A (0.36) ALDH1A1
SCHEMBL8942970 0.68 HSD17B2 (0.50) ESR1NPC1RAB9AALDH1A1
SCHEMBL6963345 0.66 NR1H2 (0.35) HDAC6PSEN1PSEN2APH1BNCSTN
SCHEMBL6971952 0.63 PIK3CD (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6188298 0.63 ALDH1A1 (0.41) HRH4ESR1ESR2NPC1RAB9A
SCHEMBL15682753 0.62 MET (0.45) METHDAC6NPC1RAB9AALDH1A1

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-5892048-A INSECTICIDES, MITICIDES NIPPON SODA CO., LTD. (JP) 1999-04-06 US disclosed
EP-0717039-A1 NOVEL TRIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 1996-06-19 EP disclosed