Dinoterb

Dinoterb

SCHEMBL8535102

CC(C)(C)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O.CC(C)(C)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.79
MEN1 O00255 3/20 0.79
HTT P42858 3/20 0.79
SMN1; SMN2 Q16637 2/20 0.79
GALR3 O60755 1/20 0.79
L3MBTL1 Q9Y468 1/20 0.79
GPR35 Q9HC97 9/20 0.61
ALDH1A1 P00352 4/20 0.61
HPGD P15428 2/20 0.59
MAPK1 P28482 2/20 0.59
MAPT P10636 2/20 0.59
KDM4E B2RXH2 1/20 0.59
TTR P02766 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2C9 P11712 1/20 0.59
ALOX15 P16050 1/20 0.59
ALOX12 P18054 1/20 0.59
RECQL P46063 1/20 0.59
PMP22 Q01453 1/20 0.59
HIF1A Q16665 1/20 0.59

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
Dinoterb SCHEMBL53794 1.00 KMT2A (0.79) KMT2AMEN1HTTSMN1; SMN2GALR3
Dinoterb SCHEMBL29487271 1.00 KMT2A (0.79) KMT2AMEN1HTTSMN1; SMN2GALR3
Dinoterb SCHEMBL424259 0.98 KMT2A (0.77) KMT2AMEN1HTTSMN1; SMN2GALR3
Dinoterb SCHEMBL11379609 0.94 KMT2A (0.70) KMT2AMEN1HTTSMN1; SMN2GALR3
Dinoterb SCHEMBL9006380 0.92 GPR35 (0.76) KMT2AMEN1HTTSMN1; SMN2GALR3
SCHEMBL3236587 0.89 MEN1 (1.00) KMT2AMEN1HTTSMN1; SMN2GALR3
Dinoterb SCHEMBL4658673 0.84 MEN1 (0.56) KMT2AMEN1HTTSMN1; SMN2GALR3
Dinoterb SCHEMBL9706953 0.84 MEN1 (0.56) KMT2AMEN1HTTSMN1; SMN2GALR3
SCHEMBL19130787 0.84 MEN1 (0.82) KMT2AMEN1HTTSMN1; SMN2GALR3
SCHEMBL397532 0.82 GPR35 (0.62) KMT2AMEN1HTTSMN1; SMN2GALR3

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
EP-0574418-B1 ARYL SULPHONYL UREA COMPOUNDS, A METHOD OF PREPARING THEM, AND THEIR USE AS HERBICIDES AND GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 1998-11-11 EP disclosed
US-5688745-A Arylsulfonylureas and their use as herbicides and growth regulators HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-18 US disclosed
US-5463081-A Chemical intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
EP-0574418-A1 ARYL SULPHONYL UREA COMPOUNDS, A METHOD OF PREPARING THEM, AND THEIR USE AS HERBICIDES AND GROWTH REGULATORS Hoechst Schering AgrEvo GmbH (DE) 1993-12-22 EP disclosed
WO-1992013845-A1 ARYL SULPHONYL UREA COMPOUNDS, A METHOD OF PREPARING THEM, AND THEIR USE AS HERBICIDES AND GROWTH REGULATORS HOECHST AKTIENGESELLSCHAFT (DE) 1992-08-20 WO disclosed
WO-1992009587-A1 HERBICIDAL OXAZINE ETHERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-06-11 WO disclosed