SCHEMBL9339488

SCHEMBL9339488

[CH2]c1ccncc1Oc1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
LMNA P02545 2/20 0.47
HTT P42858 2/20 0.47
MAPT P10636 1/20 0.47
ICAM1 P05362 1/20 0.39
SELE P16581 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.37
PTGS1 P23219 6/20 0.37
PTGS2 P35354 6/20 0.37
TRPA1 O75762 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL9339328 0.82 PTGS1 (0.52) LMNAMAPTICAM1SELEKMT2A
SCHEMBL9339335 0.81 PTGS1 (0.50) LMNAPTGS1PTGS2ALDH1A1
SCHEMBL9339489 0.79 CA12 (0.53) CA12CA1CA2CA9LMNA
SCHEMBL30644871 0.77 CA12 (0.55) CA12CA1CA2CA9LMNA
SCHEMBL24363076 0.76 CA12 (0.50) CA12CA1CA2CA9LMNA
SCHEMBL31395414 0.75 CA12 (0.60) CA12CA1CA2CA9LMNA
SCHEMBL3755349 0.75 ALDH1A1 (0.49) LMNAHTTMAPTKMT2AMEN1
SCHEMBL21056897 0.73 CA12 (0.51) CA12CA1CA2CA9LMNA
SCHEMBL29011979 0.73 L3MBTL1 (0.51) CA12CA1CA2CA9LMNA
SCHEMBL7307843 0.72 MAPK14 (0.51) CA12CA1CA2CA9LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0317265-B1 Novel imidate insecticides ZENECA INC (US) 1994-06-01 EP disclosed
US-5089623-A Certain imidate insecticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-02-18 US disclosed
US-5070210-A Novel ketenimines as intermediates for insecticides ICI AMERICAS INC. (US) 1991-12-03 US disclosed
US-5070097-A MITICIDES ICI AMERICAS INC. (US) 1991-12-03 US disclosed
US-5064846-A Heterocyclic insecticides ICI AMERICAS INC. (US) 1991-11-12 US disclosed
US-5045566-A Phenyl or naphthyl substituted ICI AMERICAS INC. (US) 1991-09-03 US disclosed
US-4994473-A For plants ICI AMERICAS INC. (US) 1991-02-19 US disclosed
US-4994488-A Controlling Lepidoptera ICI AMERICAS INC. (US) 1991-02-19 US disclosed
EP-0317265-A2 Novel imidate insecticides ZENECA INC. (US) 1989-05-24 EP disclosed
EP-0317259-A2 Heterocyclic insecticides ICI AMERICAS INC. (US) 1989-05-24 EP disclosed