SCHEMBL10114623

SCHEMBL10114623

CCOOSCc1csc(NC(=O)c2ccc(OC(C)=O)c(Cl)c2C)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
PKM P14618 1/20 0.41
MAPT P10636 5/20 0.40
CYP1A2 P05177 3/20 0.40
CYP2C9 P11712 3/20 0.40
CYP2C19 P33261 3/20 0.40
CYP3A4 P08684 2/20 0.40
NPSR1 Q6W5P4 2/20 0.38
PDE5A O76074 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MAPK1 P28482 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
USP2 O75604 1/20 0.37
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL10114444 0.84 MAPT (0.40) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL16257684 0.82 ALDH1A1 (0.41) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL4757309 0.70 NPC1 (0.47) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL10114546 0.67 LMNA (0.41) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL13907030 0.67 LMNA (0.42) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL24770658 0.66 MAPK1 (0.62) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL12974234 0.66 SMN1; SMN2 (0.47) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL16257639 0.65 PDE5A (0.40) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL10114469 0.65 MAPK1 (0.42) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL16256829 0.65 NPC1 (0.66) ALDH1A1MEN1KMT2APKMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC ALDH1A1 1605/4885MEN1 4564/4885KMT2A 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.