SCHEMBL9338802

SCHEMBL9338802

[CH2]c1cccc(Oc2ccc(I)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 1/20 0.45
MITF O75030 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
GFER P55789 1/20 0.45
KMT2A Q03164 1/20 0.45
NLRP1 Q9C000 1/20 0.45
NOD2 Q9HC29 1/20 0.45
MAOB P27338 1/20 0.39
FURIN P09958 2/20 0.39
F2 P00734 1/20 0.39
F10 P00742 1/20 0.39
LTA4H P09960 4/20 0.37
TSHR P16473 1/20 0.37
TNKS O95271 1/20 0.37
PARP15 Q460N3 1/20 0.37
PARP14 Q460N5 1/20 0.37
PARP10 Q53GL7 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
SCHEMBL5535322 0.86 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2MEN1MITFGAA
SCHEMBL3843809 0.85 SMN1; SMN2 (0.60) ALDH1A1SMN1; SMN2MEN1MITFGAA
SCHEMBL3843620 0.85 SMN1; SMN2 (0.60) ALDH1A1SMN1; SMN2MEN1MITFGAA
SCHEMBL95809 0.83 LTA4H (0.57) ALDH1A1SMN1; SMN2MEN1MITFGAA
SCHEMBL74818 0.81 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2MEN1MITFGAA
SCHEMBL9343331 0.81 LTA4H (0.55) ALDH1A1SMN1; SMN2MEN1MITFGAA
SCHEMBL2092307 0.80 MAOB (0.47) ALDH1A1SMN1; SMN2MEN1MITFGAA
SCHEMBL9339340 0.80 MAPT (0.47) ALDH1A1SMN1; SMN2MEN1MITFGAA
SCHEMBL2091035 0.80 HTT (0.53) ALDH1A1SMN1; SMN2MEN1MITFGAA
SCHEMBL3085815 0.80 LTA4H (0.59) ALDH1A1SMN1; SMN2MEN1MITFGAA

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