SCHEMBL13610433

SCHEMBL13610433

c1ccc(-c2cc(CSSSCc3ccc4scnc4c3)no2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.45
TDP1 Q9NUW8 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
RAB9A P51151 2/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MPO P05164 1/20 0.36
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HIF1A Q16665 1/20 0.35
CXCR1 P25024 2/20 0.34
NPC1 O15118 1/20 0.34
RIPK2 O43353 2/20 0.33
EGFR P00533 1/20 0.33
KDR P35968 1/20 0.33
TGFBR1 P36897 1/20 0.33
RIPK3 Q9Y572 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TRPV1 Q8NER1 2/20 0.33
PPARA Q07869 1/20 0.32

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
SCHEMBL13610453 0.81 TDP1 (0.48) NOTUMTDP1L3MBTL1RAB9AALDH1A1
SCHEMBL13610431 0.79 SMN1; SMN2 (0.40) TDP1L3MBTL1RAB9AALDH1A1SMN1; SMN2
SCHEMBL13610344 0.77 TDP1 (0.51) NOTUMTDP1L3MBTL1RAB9AALDH1A1
SCHEMBL13610439 0.76 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2HSD17B10
SCHEMBL13610429 0.75 ALDH1A1 (0.37) L3MBTL1RAB9AALDH1A1SMN1; SMN2HPGD
SCHEMBL13610469 0.74 NOTUM (0.51) NOTUMTDP1L3MBTL1RAB9AALDH1A1
SCHEMBL13610302 0.74 RAB9A (0.53) NOTUMTDP1L3MBTL1RAB9AALDH1A1
SCHEMBL13610432 0.74 ALDH1A1 (0.33) ALDH1A1HSD17B10
SCHEMBL13610350 0.73 TDP1 (0.41) TDP1L3MBTL1RAB9AALDH1A1SMN1; SMN2
SCHEMBL13610430 0.73 NAMPT (0.36) ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1742635-B1 SUBSTITUTED ORGANOSULFUR COMPOUNDS AND METHODS OF USING THEREOF ACEA BIOSCIENCES INC (US) 2018-03-07 EP disclosed
US-8334316-B2 Substituted organosulfur compounds and methods of using thereof ACEA BIOSCIENCES, INC. (US) 2012-12-18 US disclosed
US-8334316-B2 Substituted organosulfur compounds and methods of using thereof ACEA BIOSCIENCES, INC. (US) 2012-12-18 US disclosed
US-7622507-B2 Substituted organosulfur compounds and methods of using thereof ACEA BIOSCIENCES INC. (US) 2009-11-24 US disclosed
US-20090192146-A1 SUBSTITUTED ORGANOSULFUR COMPOUNDS AND METHODS OF USING THEREOF ACEA BIOSCIENCES, INC. (US) 2009-07-30 US disclosed
US-20090192146-A1 SUBSTITUTED ORGANOSULFUR COMPOUNDS AND METHODS OF USING THEREOF ACEA BIOSCIENCES, INC. (US) 2009-07-30 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-20090192146-A1 SUBSTITUTED ORGANOSULFUR COMPOUNDS AND METHODS OF USING THEREOF TST, CTH, CBS NOTUM 756/4885TDP1 1801/4885L3MBTL1 884/4885

“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.