SCHEMBL8560878

SCHEMBL8560878

CC(C(=O)c1cccc(Oc2ccc(C(F)(F)F)cc2Cl)c1)[N+](=O)[O-]

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.53
▸ KMT2A Q03164 5/20 0.53
▸ TTR P02766 1/20 0.53
▸ PPOX P50336 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ FFAR1 O14842 3/20 0.47
▸ MRGPRX4 Q96LA9 7/20 0.46
▸ LMNA P02545 6/20 0.45
▸ SMN1; SMN2 Q16637 5/20 0.45
▸ ALDH1A1 P00352 5/20 0.45
▸ POLB P06746 1/20 0.45
▸ MAPT P10636 2/20 0.44
▸ GPR55 Q9Y2T6 1/20 0.44
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43

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 0.88 MEN1 (0.52) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10378886 0.87 MEN1 (0.51) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10378575 0.87 MEN1 (0.51) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10378779 0.87 MEN1 (0.51) MEN1KMT2ATTRPPOXTDP1
Ammonia Solution, Strong SCHEMBL10379183 0.87 MEN1 (0.51) MEN1KMT2ATTRPPOXTDP1
SCHEMBL10734712 0.87 MEN1 (0.51) MEN1KMT2ATTRPPOXTDP1
SCHEMBL9137901 0.87 MEN1 (0.48) MEN1KMT2ATTRPPOXTDP1
Methylamine SCHEMBL10732420 0.86 MEN1 (0.50) MEN1KMT2ATTRPPOXTDP1
Dimethylamine SCHEMBL10728847 0.85 MEN1 (0.49) MEN1KMT2ATTRPPOXTDP1
Ammonia Solution, Strong SCHEMBL11124803 0.85 FFAR1 (0.50) 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0548593-B1 Tetrahydrofuran derivative and herbicide containing the same as effective ingredient MITSUBISHI CHEM CORP (JP) 1998-04-22 — — EP disclosed
US-5407808-A Treating tumor with inhibitor of protoporphyrinogen conversion to heme FMC CORPORATION (US) 1995-04-18 — — US disclosed
US-5405828-A Selective pre- and postemergence herbicides MITSUBISHI KASEI CORPORATION (JP) 1995-04-11 — — US disclosed
US-5324709-A Safety on crops MITSUBISHI KASEI CORPORATION (JP) 1994-06-28 — — US disclosed
US-5298502-A Exposure to light in presence of oxidase inhibitor FMC CORPORATION (US) 1994-03-29 — — US disclosed
EP-0447491-B1 PROTOPORPHYRINOGEN INHIBITORS AND THEIR USE IN COMPOSITIONS FOR DETECTING AND TREATING TUMOURS FMC CORP (US) 1993-08-11 — — EP disclosed
EP-0548593-A1 Tetrahydrofuran derivative and herbicide containing the same as effective ingredient Mitsubishi Chemical Corporation (JP) 1993-06-30 — — EP disclosed
WO-1991019418-A1 TREATMENT OF DISEASE FMC CORPORATION (US) 1991-12-26 — — WO disclosed
EP-0447491-A1 Protoporphyrinogen inhibitors and their use in compositions for detecting and treating Tumours. FMC CORP (US) 1991-09-25 — — EP disclosed
WO-1990006748-A2 USE OF CERTAIN HERBICIDES IN CANCER TREATMENT AND PRODUCTION OF PROTOPORPHYRIN IX FMC CORPORATION (US) 1990-06-28 — — WO disclosed
US-4401602-A PRE- AND POSTEMERGENCE HERBICIDES; DESICCANTS; DEFOLIATION; PLANT GROWTH REGULATORS PPG INDUSTRIES, INC. (US) 1983-08-30 — — US disclosed
US-4344789-A Acids and esters of 5-(2-optionally substituted-4-trifluoromethyl-6-optionally substituted phenoxy)-2-nitro, -halo, or-cyano alpha substituted phenyl carboxy oximes, and method of controlling weeds with them PPG INDUSTRIES, INC. (US) 1982-08-17 — — US disclosed
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