SCHEMBL4756880

SCHEMBL4756880

CCCCS(=O)(=O)c1cnc(NC(=O)c2cccc(O)c2Cl)s1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 5/20 0.45
STAT3 P40763 2/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
CRHBP P24387 2/20 0.39
CRHR2 Q13324 2/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 3/20 0.39
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
DCTPP1 Q9H773 1/20 0.36
STIM1 Q13586 1/20 0.35
ORAI1 Q96D31 1/20 0.35
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL4756407 0.89 STAT3 (0.51) GRM4STAT3MEN1KMT2ACRHBP
SCHEMBL4757140 0.82 GRM4 (0.45) GRM4STAT3MEN1KMT2AMAPT
SCHEMBL4757028 0.80 NPC1 (0.46) MEN1KMT2AMAPTALDH1A1NPC1
SCHEMBL19978237 0.79 ALDH1A1 (0.54) GRM4MEN1KMT2AMAPTALDH1A1
SCHEMBL4756409 0.79 ALDH1A1 (0.57) GRM4STAT3MEN1KMT2ACRHBP
SCHEMBL4756651 0.73 GRM4 (0.49) GRM4STAT3MEN1KMT2ACRHBP
SCHEMBL4756878 0.73 STAT3 (0.44) GRM4STAT3MEN1KMT2ACRHBP
SCHEMBL4756965 0.73 FFAR2 (0.48) GRM4STAT3MEN1KMT2ACRHBP
SCHEMBL16918852 0.72 GRM4 (0.42) GRM4STAT3MEN1KMT2ACRHBP
SCHEMBL31426452 0.72 STAT3 (0.58) GRM4STAT3MEN1KMT2ACRHBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2178852-B9 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LAB LC (US) 2016-06-22 EP disclosed
EP-2178852-B1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LAB LC (US) 2015-07-22 EP disclosed
US-8895752-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES L.C. (US) 2014-11-25 US disclosed
US-8895752-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES L.C. (US) 2014-11-25 US disclosed
US-20120122939-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LABORATORIES, L.C. 2012-05-17 US disclosed
US-8124632-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES, L.C. (US) 2012-02-28 US disclosed
US-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LABORATORIES L.C. 2009-02-05 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 (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-20120122939-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC GRM4 4380/4885STAT3 63/4885MEN1 4564/4885
US-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC GRM4 4380/4885STAT3 63/4885MEN1 4564/4885

“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.