SCHEMBL4757003

SCHEMBL4757003

CCS(=O)(=O)Cc1csc(NC(=O)c2ccc(Cl)c(O)c2C)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 2/20 0.45
ALDH1A1 P00352 4/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
PKM P14618 1/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
CYP1A2 P05177 3/20 0.40
CYP2C9 P11712 3/20 0.40
CYP2C19 P33261 3/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
PDE1A P54750 1/20 0.40
PDE1B Q01064 1/20 0.40
PDE1C Q14123 1/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TP53 P04637 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL16257684 0.81 ALDH1A1 (0.41) PDE5AALDH1A1KMT2AMEN1PKM
SCHEMBL4757222 0.81 PDE5A (0.43) PDE5AALDH1A1KMT2AMEN1PKM
SCHEMBL4756885 0.79 LMNA (0.40) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL16257639 0.75 PDE5A (0.40) PDE5AALDH1A1KMT2AMEN1PKM
SCHEMBL4757309 0.71 NPC1 (0.47) PDE5AALDH1A1KMT2AMEN1PKM
SCHEMBL4756668 0.70 NPC1 (0.48) PDE5AALDH1A1KMT2AMEN1PKM
SCHEMBL12974329 0.68 NPC1 (0.63) PDE5AALDH1A1KMT2AMEN1NPC1
SCHEMBL4757025 0.68 NPC1 (0.40) PDE5AALDH1A1KMT2AMEN1PKM
SCHEMBL3513099 0.68 ALDH1A1 (0.50) PDE5AALDH1A1KMT2AMEN1NPC1
SCHEMBL4757088 0.68 NPC1 (0.44) PDE5AALDH1A1KMT2AMEN1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PDE5A 4694/4885ALDH1A1 1605/4885KMT2A 2303/4885
US-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC PDE5A 4694/4885ALDH1A1 1605/4885KMT2A 2303/4885

“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.