SCHEMBL9338808

SCHEMBL9338808

O=C(Nc1ccccc1)C(CF)CF

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
POLB P06746 1/20 0.55
SMN1; SMN2 Q16637 4/20 0.51
MAPT P10636 5/20 0.50
ALDH1A1 P00352 4/20 0.50
GAA P10253 2/20 0.50
ATM Q13315 2/20 0.50
TP53 P04637 1/20 0.50
EPHX1 P07099 1/20 0.50
TSHR P16473 1/20 0.50
EPHX2 P34913 1/20 0.50
CDK9 P50750 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
LMNA P02545 1/20 0.50
MAPK1 P28482 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 1/20 0.50
HSP90AA1 P07900 2/20 0.49

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
SCHEMBL9340623 0.89 MEN1 (0.53) MEN1KMT2APOLBSMN1; SMN2MAPT
SCHEMBL21056246 0.82 MEN1 (0.61) MEN1KMT2APOLBSMN1; SMN2MAPT
SCHEMBL29154468 0.80 MEN1 (0.59) MEN1KMT2APOLBSMN1; SMN2MAPT
SCHEMBL4681925 0.80 MEN1 (0.86) MEN1KMT2APOLBSMN1; SMN2MAPT
SCHEMBL7615195 0.80 MEN1 (0.59) MEN1KMT2APOLBSMN1; SMN2MAPT
SCHEMBL11879432 0.79 MEN1 (0.54) MEN1KMT2APOLBSMN1; SMN2MAPT
SCHEMBL20621920 0.77 MEN1 (0.65) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL1703604 0.77 POLB (0.61) MEN1KMT2APOLBSMN1; SMN2MAPT
SCHEMBL8410641 0.76 MEN1 (0.54) MEN1KMT2APOLBSMN1; SMN2MAPT
SCHEMBL12335729 0.74 MEN1 (0.71) MEN1KMT2ASMN1; SMN2MAPTALDH1A1

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 5 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-5045566-A Phenyl or naphthyl substituted ICI AMERICAS INC. (US) 1991-09-03 US disclosed
EP-0317265-A2 Novel imidate insecticides ZENECA INC. (US) 1989-05-24 EP disclosed