SCHEMBL9632353

SCHEMBL9632353

O=C(CF)Nc1ccc(Cl)c(Oc2ccc([N+](=O)[O-])cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.54
▸ KMT2A Q03164 9/20 0.54
▸ GAA P10253 3/20 0.54
▸ PKM P14618 1/20 0.54
▸ MAPT P10636 8/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ NPSR1 Q6W5P4 2/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ MYOC Q99972 1/20 0.50
▸ FNTA P49354 1/20 0.47
▸ FNTB P49356 1/20 0.47
▸ LMNA P02545 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ XBP1 P17861 1/20 0.47
▸ CCR6 P51684 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.46
▸ POLB P06746 2/20 0.46
▸ MMP1 P03956 1/20 0.45

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
SCHEMBL9631086 0.84 STK39 (0.48) KMT2AMAPTFNTAFNTBLMNA
SCHEMBL9633353 0.83 PNLIP (0.46) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL8462705 0.78 MEN1 (0.65) MEN1KMT2AGAAMAPTRAB9A
SCHEMBL8876963 0.76 KMT2A (0.63) MEN1KMT2AGAAMAPTRAB9A
SCHEMBL4682789 0.76 MEN1 (0.68) MEN1KMT2AGAAPKMMAPT
SCHEMBL4682794 0.76 MEN1 (0.68) MEN1KMT2AGAAPKMMAPT
SCHEMBL2814306 0.74 HSPB1 (0.68) MEN1KMT2AGAAPKMMAPT
SCHEMBL9629003 0.74 PDE7A (0.56) MEN1KMT2AGAAPKMMAPT
SCHEMBL23748585 0.73 MEN1 (0.70) MEN1KMT2AMAPTRAB9ANPSR1
SCHEMBL27137471 0.73 KMT2A (0.69) MEN1KMT2AGAAMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5084085-A Plant growth regulators FMC CORPORATION (US) 1992-01-28 — — US disclosed
US-4885025-A A PHENOXY-,-AMINO-,-ALKYLAMINO- OR -SULFIDO-SUBSTITUTED PHENYL ON THE NUMBER 1 RING NITROGEN FMC CORPORATION (US) 1989-12-05 — — US disclosed
EP-0322413-A4 HERBICIDES. FMC CORP (US) 1989-10-04 — — EP disclosed
EP-0322413-A1 HERBICIDES FMC Corporation (US) 1989-07-05 — — EP disclosed
US-4816065-A ARYLTETRAHYDROPHTHALIMIDES FMC CORPORATION (US) 1989-03-28 — — US disclosed
WO-1988001133-A1 HERBICIDES FMC CORPORATION (US) 1988-02-25 — — WO disclosed
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