SCHEMBL4262202

SCHEMBL4262202

c1csc(CSSSCc2cccs2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.46
ALDH1A1 P00352 3/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
HSD17B10 Q99714 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
HPGD P15428 2/20 0.41
ADRA2A P08913 3/20 0.41
ADRA2B P18089 3/20 0.41
ADRA2C P18825 3/20 0.41
CYP2C19 P33261 1/20 0.41
POLB P06746 3/20 0.38
HTT P42858 1/20 0.38
FBP1 P09467 1/20 0.37
TSHR P16473 2/20 0.37
MAPT P10636 1/20 0.37
METAP2 P50579 1/20 0.36
PKM P14618 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL13610339 0.84 HPGD (0.46) ALDH1A1NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL13610468 0.81 SMN1; SMN2 (0.47) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL11445152 0.80 MEN1 (0.43) TAAR1ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL5144954 0.80 ALDH1A1 (0.51) TAAR1ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL13610295 0.80 L3MBTL1 (0.50) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL13610409 0.79 TSHR (0.47) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL13610491 0.79 TSHR (0.37) TAAR1ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL11445399 0.77 TAAR1 (0.39) TAAR1ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL13610449 0.76 ALDH1A1 (0.46) ALDH1A1NPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL1145720 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1742635-A2 SUBSTITUTED ORGANOSULFUR COMPOUNDS AND METHODS OF USING THEREOF Acea Biosciences, Inc. (US) 2007-01-17 EP claimed
WO-2005112933-A2 SUBSTITUTED ORGANOSULFUR COMPOUNDS AND METHODS OF USING THEREOF ACEA BIOSCIENCES INC. (US) 2005-12-01 WO claimed
US-20050261321-A1 Substituted organosulfur compounds and methods of using thereof ACEA Therapeutics, Inc. 2005-11-24 US claimed
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-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
EP-1742635-A2 SUBSTITUTED ORGANOSULFUR COMPOUNDS AND METHODS OF USING THEREOF Acea Biosciences, Inc. (US) 2007-01-17 EP disclosed
WO-2005112933-A2 SUBSTITUTED ORGANOSULFUR COMPOUNDS AND METHODS OF USING THEREOF ACEA BIOSCIENCES INC. (US) 2005-12-01 WO disclosed
US-20050261321-A1 Substituted organosulfur compounds and methods of using thereof ACEA Therapeutics, Inc. 2005-11-24 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-20090192146-A1 SUBSTITUTED ORGANOSULFUR COMPOUNDS AND METHODS OF USING THEREOF TST, CTH, CBS TAAR1 1526/4885ALDH1A1 285/4885NPC1 3127/4885
US-20050261321-A1 Substituted organosulfur compounds and methods of using thereof TST, CTH, CBS TAAR1 1526/4885ALDH1A1 285/4885NPC1 3127/4885

“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.