SCHEMBL13610409

SCHEMBL13610409

C(=C/c1ccccc1)\CSSSCc1cccs1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 4/20 0.41
ALDH1A1 P00352 3/20 0.40
HSD17B10 Q99714 2/20 0.40
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
TP53 P04637 2/20 0.38
MAPT P10636 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38

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
SCHEMBL4265198 0.80 RAB9A (0.52) L3MBTL1RAB9ANPC1TDP1
SCHEMBL4262202 0.79 TAAR1 (0.46) TSHRLMNAL3MBTL1ALDH1A1HSD17B10
SCHEMBL1247981 0.74 TSHR (0.46) TSHRMEN1KMT2ALMNAL3MBTL1
SCHEMBL1247980 0.74 TSHR (0.46) TSHRMEN1KMT2ALMNAL3MBTL1
SCHEMBL13610408 0.73 ALDH1A1 (0.46) TSHRMEN1KMT2ALMNAL3MBTL1
SCHEMBL387863 0.73 RAB9A (0.55) L3MBTL1RAB9ANPC1TDP1
SCHEMBL387862 0.73 RAB9A (0.55) L3MBTL1RAB9ANPC1TDP1
SCHEMBL13610347 0.72 NFE2L2 (0.46) MEN1KMT2ALMNAL3MBTL1ALDH1A1
SCHEMBL13610410 0.71 RAB9A (0.55) TSHRKMT2ALMNAL3MBTL1ALDH1A1
SCHEMBL13610417 0.69 L3MBTL1 (0.42) TSHRKMT2AL3MBTL1ALDH1A1RAB9A

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
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-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 TSHR 1867/4885MEN1 2581/4885KMT2A 646/4885

“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.