SCHEMBL4755933

SCHEMBL4755933

COc1ccccc1C(=O)Nc1ncc(S(C)(=O)=O)s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.57
NPC1 O15118 7/20 0.57
MEN1 O00255 7/20 0.57
KMT2A Q03164 7/20 0.57
TP53 P04637 5/20 0.57
ALDH1A1 P00352 4/20 0.57
KDM4E B2RXH2 3/20 0.57
HPGD P15428 3/20 0.57
NPSR1 Q6W5P4 2/20 0.57
HSD17B10 Q99714 2/20 0.57
PKM P14618 2/20 0.55
PAX8 Q06710 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
SMN1; SMN2 Q16637 4/20 0.51
GAA P10253 2/20 0.51
MAPT P10636 6/20 0.51
THRB P10828 2/20 0.51
RXFP1 Q9HBX9 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 2/20 0.49

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
SCHEMBL4757768 0.90 MEN1 (0.52) RAB9ANPC1MEN1KMT2ATP53
SCHEMBL10113734 0.90 KLKB1 (0.48) RAB9ANPC1MEN1KMT2ATP53
SCHEMBL4755965 0.89 RAB9A (0.48) RAB9ANPC1MEN1KMT2ATP53
SCHEMBL705921 0.88 ALDH1A1 (0.64) RAB9ANPC1MEN1KMT2ATP53
SCHEMBL31426449 0.86 DDX3X (0.50) RAB9ANPC1MEN1KMT2ATP53
SCHEMBL10232846 0.85 ALDH1A1 (0.46) RAB9ANPC1MEN1KMT2ATP53
SCHEMBL4757584 0.85 KMT2A (0.50) RAB9ANPC1MEN1KMT2ATP53
SCHEMBL4757510 0.85 ALDH1A1 (0.50) RAB9ANPC1MEN1KMT2ATP53
SCHEMBL4757570 0.85 MEN1 (0.50) RAB9ANPC1MEN1KMT2ATP53
SCHEMBL31426452 0.84 STAT3 (0.58) RAB9ANPC1MEN1KMT2ATP53

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 RAB9A 1694/4885NPC1 585/4885MEN1 4564/4885
US-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC RAB9A 1694/4885NPC1 585/4885MEN1 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.