SCHEMBL6105232

SCHEMBL6105232

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2cc(N(C(N)=O)c3nc(OC)cc(OC)n3)ccc2C(=O)N(C)C)n1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.66
GAA P10253 1/20 0.48
CYP1A2 P05177 1/20 0.36
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
GLA P06280 1/20 0.35
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL7924847 0.85 CDK1 (0.70) CDK1GAACYP1A2MAPTTP53
SCHEMBL6105199 0.84 CDK1 (0.72) CDK1GAACYP1A2MAPTTP53
SCHEMBL2977300 0.84 CDK1 (0.72) CDK1GAACYP1A2MAPTTP53
SCHEMBL6105235 0.82 CDK1 (0.82) CDK1GAACYP1A2MAPTTP53
SCHEMBL13043135 0.82 CDK1 (0.80) CDK1GAACYP1A2MAPTTP53
SCHEMBL10509250 0.81 CDK1 (0.70) CDK1GAACYP1A2MAPTTP53
SCHEMBL2977298 0.81 CDK1 (0.79) CDK1GAACYP1A2MAPTTP53
SCHEMBL28551087 0.81 CDK1 (0.79) CDK1GAACYP1A2MAPTTP53
SCHEMBL6106106 0.81 CDK1 (0.79) CDK1GAACYP1A2MAPTTP53
SCHEMBL1652674 0.81 CDK1 (0.76) CDK1GAACYP1A2MAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7057043-B2 Processes for preparing aminophenylsulfonylureas, and intermediates therefor HOECHST SCHERING AGREVO GMBH (DE) 2006-06-06 US disclosed
US-20050033047-A1 Processes for preparing aminophenylsulfonylureas, and intermediates therefor BAYER INTELLECTUAL PROPERTY GMBH (DE) 2005-02-10 US disclosed
US-6790955-B2 REACTING 2-SULFONAMIDO, NITROBENZOIC ACID COMPOUND WITH IN THE PRESENCE OF A HALOGENATING AGENT, WITH FORMATION OF THE CARBONYL HALIDE AND ITS REARRANGEMENT; AMMONOLYSIS AT SO2CL GROUP REDUCING AT THE NITRO GROUP; REACTING WITH CARBAMATE HOECHST SCHERING AGREVO GMBH (DE) 2004-09-14 US disclosed
US-20030096991-A1 Processes for the preparation of aminophenylsulfonyl-ureas and intermediate products for the processes BAYER INTELLECTUAL PROPERTY GMBH (DE) 2003-05-22 US disclosed
US-6500952-B1 SUCH AS 5-AMINO-2-DIMETHYLAMINOCARBONYL-N-((4,6-DIMETHOXY-PYRIMIDIN-2-YL) -AMINOCARBONYL)BENZENESULFONAMIDE; HERBICIDES OR PLANT GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 2002-12-31 US disclosed
EP-0858447-B1 METHODS OF PRODUCING AMINOPHENYLSULPHONYL CARBAMIDES AND INTERMEDIATE PRODUCTS FOR USE IN THE PROCESS AVENTIS CROPSCIENCE GMBH (DE) 2002-01-09 EP disclosed
EP-0858447-A1 METHODS OF PRODUCING AMINOPHENYLSULPHONYL CARBAMIDES AND INTERMEDIATE PRODUCTS FOR USE IN THE PROCESS Hoechst Schering AgrEvo GmbH (DE) 1998-08-19 EP disclosed
WO-1997016419-A1 METHODS OF PRODUCING AMINOPHENYLSULPHONYL CARBAMIDES AND INTERMEDIATE PRODUCTS FOR USE IN THE PROCESS HOECHST SCHERING AGREVO GMBH (DE) 1997-05-09 WO 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 (2 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-20050033047-A1 Processes for preparing aminophenylsulfonylureas, and intermediates therefor HNMT, PRMT3, CBR3 CDK1 505/4885GAA 4676/4885CYP1A2 1728/4885
US-20030096991-A1 Processes for the preparation of aminophenylsulfonyl-ureas and intermediate products for the processes HNMT, CPS1, HRH4 CDK1 298/4885GAA 3678/4885CYP1A2 541/4885

“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.