SCHEMBL9488809

SCHEMBL9488809

O=C(Oc1ccc([N+](=O)[O-])cc1)C(Cl)(Cl)Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.56
BCL9 O00512 1/20 0.53
CTNNB1 P35222 1/20 0.53
KMT2A Q03164 3/20 0.51
PKM P14618 1/20 0.51
PTPN7 P35236 1/20 0.48
PTPN12 Q05209 1/20 0.48
PTPN22 Q9Y2R2 1/20 0.48
ALDH1A1 P00352 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CES1 P23141 2/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CES2 O00748 1/20 0.47
MAPT P10636 2/20 0.47
MGLL Q99685 1/20 0.47
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL1456652 0.82 ELANE (0.52) KMT2ASMN1; SMN2MEN1RAB9A
SCHEMBL734833 0.82 GAA (0.56) GAABCL9CTNNB1KMT2APKM
SCHEMBL4941164 0.82 ELANE (0.61) GAABCL9CTNNB1KMT2APKM
SCHEMBL3310085 0.81 GAA (0.58) GAABCL9CTNNB1KMT2APKM
SCHEMBL8610510 0.80 GAA (0.54) GAABCL9CTNNB1KMT2APKM
SCHEMBL15168 0.79 GAA (0.61) GAABCL9CTNNB1KMT2APKM
SCHEMBL21853704 0.79 GAA (0.57) GAABCL9CTNNB1KMT2APKM
SCHEMBL27301103 0.79 GAA (0.57) GAABCL9CTNNB1KMT2APKM
SCHEMBL28011502 0.79 GAA (0.53) GAABCL9CTNNB1KMT2APKM
SCHEMBL26374 0.79 GAA (0.65) GAABCL9CTNNB1KMT2APKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0341585-B1 PRODUCTION OF 3,5,6-TRICHLORO-PYRIDIN-2-OL AND NOVEL INTERMEDIATES THEREOF LUXEMBOURG INDUSTRIES (PAMOL) LTD. (IL) 1993-01-13 EP disclosed
US-5017705-A Production of 3,5,6-trichloropyridin-2 ol and novel intermediates thereof LUXEMBOURG INDUSTRIES (PAMOL) LTD. (IL) 1991-05-21 US disclosed
EP-0341585-A1 Production of 3,5,6-trichloro-pyridin-2-ol and novel intermediates thereof LUXEMBOURG INDUSTRIES (PAMOL) LTD. (IL) 1989-11-15 EP disclosed
US-4518802-A IMMUNOSTIMULANT ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1985-05-21 US disclosed
US-4500452-A NOT SUBJECT TO ENZYME DEACTIVATION NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1985-02-19 US disclosed
US-4472304-A CARCINOSTATIC NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1984-09-18 US disclosed
US-4334111-A PYROLYSIS OF PHENYL TRIHALOACETATE THE DOW CHEMICAL COMPANY (US) 1982-06-08 US disclosed
US-4238391-A AMIDATION OF BLEOMYCINIC ACID NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1980-12-09 US disclosed
US-4195018-A CARCINOSTATIC ANTIBIOTICS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1980-03-25 US disclosed