SCHEMBL4522845

SCHEMBL4522845

NC(=S)Nc1cccc(S(N)(=O)=O)c1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA1 P00915 13/20 0.64
CA2 P00918 13/20 0.64
CA9 Q16790 10/20 0.64
CA12 O43570 7/20 0.64
MAPT P10636 2/20 0.64
ALDH1A1 P00352 1/20 0.59
PKM P14618 1/20 0.59
POLB P06746 1/20 0.57

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
SCHEMBL16771334 0.88 CA1 (0.62) CA1CA2CA9CA12MAPT
SCHEMBL4524583 0.85 CYP1A2 (0.57) CA1CA2CA9CA12MAPT
SCHEMBL359383 0.84 CA1 (0.73) CA1CA2CA9CA12MAPT
SCHEMBL7616638 0.83 CA1 (0.74) CA1CA2CA9CA12MAPT
SCHEMBL18955311 0.83 CA1 (0.64) CA1CA2CA9CA12MAPT
SCHEMBL1593097 0.83 CA1 (0.64) CA1CA2CA9CA12MAPT
SCHEMBL361047 0.83 CA1 (0.64) CA1CA2CA9CA12MAPT
Hydrochloric Acid SCHEMBL2433442 0.81 CA1 (0.62) CA1CA2CA9CA12MAPT
SCHEMBL15325019 0.81 CA1 (0.62) CA1CA2CA9CA12MAPT
SCHEMBL27747721 0.81 CA1 (0.76) CA1CA2CA9CA12MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9150561-B2 Thiazole derivatives and use thereof MERCK SERONO S.A. (CH) 2015-10-06 US disclosed
US-20140228365-A1 THIAZOLE DERIVATIVES AND USE THEREOF MERCK SERONO S.A. (CH) 2014-08-14 US disclosed
US-8802861-B2 Thiazole derivatives and use thereof MERCK SERONO SA (CH) 2014-08-12 US disclosed
US-20090029998-A1 Thiazole Derivatives and Use Thereof APPLIED RESEARCH SYSTEM ARS HOLDING N.V. (NL) 2009-01-29 US disclosed
EP-1709019-B1 THIAZOLE DERIVATIVES AND USE THEREOF APPLIED RESEARCH SYSTEMS (AN) 2007-08-08 EP disclosed
US-7253197-B2 Aminothiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed
US-7253197-B2 Aminothiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed
US-7253197-B2 Aminothiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed
EP-1709019-A2 THIAZOLE DERIVATIVES AND USE THEREOF Applied Research Systems ARS Holding N.V. (AN) 2006-10-11 EP disclosed
WO-2005068444-A2 THIAZOLE DERIVATIVES AND USE THEREOF APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2005-07-28 WO disclosed
EP-1539722-A1 THIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-06-15 EP disclosed
US-20040038990-A1 Aminothiazole derivatives HOFFMANN-LA ROCHE INC. 2004-02-26 US disclosed
WO-2004014884-A1 THIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2004-02-19 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 (3 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-20140228365-A1 THIAZOLE DERIVATIVES AND USE THEREOF PF4, TEC, PDGFRB CA1 4717/4885CA2 3950/4885CA9 1678/4885
US-20090029998-A1 Thiazole Derivatives and Use Thereof PDGFRB, PDGFRA, TEC CA1 4521/4885CA2 4024/4885CA9 3061/4885
US-20040038990-A1 Aminothiazole derivatives FABP4, GPR119, ABAT CA1 4356/4885CA2 3572/4885CA9 3065/4885

“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.