SCHEMBL11079262

SCHEMBL11079262

CO/C(=N\C(=O)Nc1ccc(OC(F)(F)C(Cl)Cl)cc1)c1ccccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.49
RAB9A P51151 2/20 0.45
ALDH1A1 P00352 2/20 0.45
EPHX2 P34913 2/20 0.41
RORC P51449 1/20 0.40
MAPT P10636 5/20 0.39
PTGS2 P35354 2/20 0.39
MT-CO2 P00403 1/20 0.38
TOP1 P11387 1/20 0.38
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
NPC1 O15118 2/20 0.37
XBP1 P17861 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
HTT P42858 1/20 0.36
SMO Q99835 1/20 0.36
XIAP P98170 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
SCHEMBL11079265 1.00 TDP1 (0.49) TDP1RAB9AALDH1A1EPHX2RORC
SCHEMBL11076262 0.92 TDP1 (0.50) TDP1RAB9AALDH1A1EPHX2RORC
SCHEMBL11076256 0.92 TDP1 (0.50) TDP1RAB9AALDH1A1EPHX2RORC
SCHEMBL11076472 0.91 TDP1 (0.47) TDP1RAB9AALDH1A1EPHX2RORC
SCHEMBL11076470 0.91 TDP1 (0.47) TDP1RAB9AALDH1A1EPHX2RORC
SCHEMBL11079910 0.90 TDP1 (0.61) TDP1RAB9AALDH1A1EPHX2MAPT
SCHEMBL11079907 0.90 TDP1 (0.61) TDP1RAB9AALDH1A1EPHX2MAPT
SCHEMBL11075800 0.90 TDP1 (0.46) TDP1RAB9AALDH1A1EPHX2RORC
SCHEMBL11075802 0.90 TDP1 (0.46) TDP1RAB9AALDH1A1EPHX2RORC
SCHEMBL11071570 0.88 PTGS2 (0.44) TDP1RAB9AALDH1A1EPHX2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4431667-A Imino ethers useful for controlling insect and arachnoid pests THE UPJOHN COMPANY (US) 1984-02-14 US disclosed