SCHEMBL186724

SCHEMBL186724

CNC(=O)N(O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
CES2 O00748 1/20 0.45
NPSR1 Q6W5P4 1/20 0.43
POLB P06746 3/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 2/20 0.42
HTT P42858 1/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL7675880 0.84 TP53 (0.54) TP53CES2NPSR1POLBRAB9A
SCHEMBL2736852 0.84 ALDH1A1 (0.50) TP53CES2NPSR1POLBLMNA
SCHEMBL17681668 0.82 CES2 (0.49) TP53CES2NPSR1POLBRAB9A
SCHEMBL10067058 0.81 ALDH1A1 (0.59) TP53POLBRAB9AMEN1KMT2A
SCHEMBL11304484 0.81 TP53 (0.47) TP53CES2NPSR1POLBRAB9A
SCHEMBL11821275 0.80 EPHX2 (0.43) CES2RAB9AMAPTALDH1A1KDM4E
SCHEMBL11876112 0.79 TP53 (0.45) TP53CES2POLBMEN1KMT2A
SCHEMBL5133571 0.78 HDAC1 (0.47) TP53CES2POLBMEN1KMT2A
SCHEMBL11833450 0.77 SMN1; SMN2 (0.47) TP53NPSR1POLBMAPTHTT
SCHEMBL9819254 0.77 RXRA (0.44) TP53RAB9AMEN1KMT2AMAPT

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9677053-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2017-06-13 US disclosed
US-9677053-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2017-06-13 US disclosed
US-9677053-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2017-06-13 US disclosed
US-20160237411-A1 LACCASES FOR BIO-BLEACHING VERENIUM CORPORATION 2016-08-18 US disclosed
US-20160237411-A1 LACCASES FOR BIO-BLEACHING VERENIUM CORPORATION 2016-08-18 US disclosed
US-20160237411-A1 LACCASES FOR BIO-BLEACHING VERENIUM CORPORATION 2016-08-18 US disclosed
US-9353477-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2016-05-31 US disclosed
US-9353477-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2016-05-31 US disclosed
US-9353477-B2 Laccases for bio-bleaching BASF ENZYMES LLC (US) 2016-05-31 US disclosed
EP-2434008-B1 Laccases for pulp bio-bleaching BASF ENZYMES LLC (US) 2015-07-08 EP disclosed
EP-2059587-B1 LACCASES FOR PULP BIO-BLEACHING VERENIUM CORP (US) 2012-01-04 EP disclosed
US-20100018658-A1 Laccases for Bio-Bleaching VERENIUM CORPORATION (US) 2010-01-28 US disclosed
US-20100018658-A1 Laccases for Bio-Bleaching VERENIUM CORPORATION (US) 2010-01-28 US disclosed
US-20100018658-A1 Laccases for Bio-Bleaching VERENIUM CORPORATION (US) 2010-01-28 US disclosed
EP-2059587-A2 LACCASES FOR PULP BIO-BLEACHING Verenium Corporation (US) 2009-05-20 EP disclosed
WO-2008027501-A2 LACCASES FOR PULP BIO-BLEACHING VERENIUM CORPORATION (US) 2008-03-06 WO disclosed
WO-2008027501-A2 LACCASES FOR PULP BIO-BLEACHING VERENIUM CORPORATION (US) 2008-03-06 WO disclosed
US-4190431-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1980-02-26 US disclosed
US-4182872-A CORRESPONDING 4-CARBOBENZOXY COMPOUNDS, 2,3,4,4A-TETRAHYDRO-1H-PYRAZINO(1,2-A)QUINOXALIN-5(6H)-ONES, 2,3,4,4A,5,6-HEXAHYDRO-1H-PYRAZINO(1,2-A)QUINOXALINES, HYPOTENSIVE AMERICAN HOME PRODUCTS CORPORATION (US) 1980-01-08 US disclosed
US-4089958-A HYPOTENSIVE AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1978-05-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100018658-A1 Laccases for Bio-Bleaching AOX1, GUSB, LPO TP53 3869/4885CES2 123/4885NPSR1 4506/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.