SCHEMBL10378575

SCHEMBL10378575

COC(C(=O)c1cccc(Oc2ccc(C(F)(F)F)cc2Cl)c1)[N+](=O)[O-].[KH]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.51
▸ KMT2A Q03164 5/20 0.51
▸ TTR P02766 1/20 0.51
▸ PPOX P50336 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ LMNA P02545 7/20 0.45
▸ SMN1; SMN2 Q16637 5/20 0.45
▸ FFAR1 O14842 3/20 0.44
▸ ALDH1A1 P00352 6/20 0.44
▸ MAPT P10636 4/20 0.44
▸ MRGPRX4 Q96LA9 5/20 0.44
▸ POLB P06746 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ GPR55 Q9Y2T6 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41

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
SCHEMBL10377601 0.99 MEN1 (0.52) MEN1KMT2ATTRPPOXTDP1
Ammonia Solution, Strong SCHEMBL10379183 0.98 MEN1 (0.51) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10378779 0.98 MEN1 (0.51) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10734712 0.98 MEN1 (0.51) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10378886 0.98 MEN1 (0.51) MEN1KMT2ATTRPPOXTDP1
Methylamine SCHEMBL10732420 0.97 MEN1 (0.50) MEN1KMT2ATTRPPOXTDP1
Dimethylamine SCHEMBL10728847 0.96 MEN1 (0.49) MEN1KMT2ATTRPPOXTDP1
SCHEMBL8560878 0.87 MEN1 (0.53) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10378572 0.87 MEN1 (0.47) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10822476 0.82 MEN1 (0.48) MEN1KMT2ATTRPPOXTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0186989-B1 5-(2-CHLORO-4-TRIFLUOROMETHYLPHENOXY)-2-NITRO-ALPHA-SUBSTITUTED-ACETOPHENONE, OXIME DERIVATIVE THEREOF, PROCESS FOR PREPARING THEREOF, HERBICIDAL COMPOSITION, AND METHOD FOR THE DESTRUCTION OF UNDESIRABLE WEEDS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1990-09-26 — — EP disclosed
US-4708734-A HIGH SELECTIVITY ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1987-11-24 — — US disclosed
EP-0186989-A2 5-(2-chloro-4-trifluoromethylphenoxy)-2-nitro-alpha-substituted-acetophenone, oxime derivative thereof, process for preparing thereof, herbicidal composition, and method for the destruction of undesirable weeds Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1986-07-09 — — EP disclosed
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