SCHEMBL13610336

SCHEMBL13610336

Fc1ccc(CSSSCc2ccco2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ALDH1A1 P00352 4/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 2/20 0.48
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 4/20 0.41
TP53 P04637 2/20 0.40
MAPK1 P28482 1/20 0.40
GFER P55789 1/20 0.40
HSD17B10 Q99714 1/20 0.40
POLB P06746 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
RECQL P46063 1/20 0.39
PLA2G7 Q13093 1/20 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
SCHEMBL25435114 0.84 TSHR (0.47) MEN1KMT2AALDH1A1HPGDTSHR
SCHEMBL25435426 0.80 TSHR (0.43) MEN1KMT2AALDH1A1HPGDTSHR
SCHEMBL1740610 0.80 IDO1 (0.50) KMT2AALDH1A1HPGDNPC1RAB9A
SCHEMBL13610294 0.80 ALDH1A1 (0.50) ALDH1A1HPGDTSHRSMN1; SMN2MAPT
SCHEMBL13610366 0.79 RAB9A (0.46) MEN1KMT2AALDH1A1HPGDTSHR
SCHEMBL891217 0.75 TSHR (0.46) MEN1KMT2AALDH1A1HPGDTSHR
SCHEMBL8310150 0.74 KMT2A (0.62) MEN1KMT2AALDH1A1HPGDTSHR
Water SCHEMBL27837138 0.73 TSHR (0.44) MEN1KMT2AALDH1A1HPGDTSHR
SCHEMBL17541243 0.73 TSHR (0.44) MEN1KMT2AALDH1A1HPGDTSHR
SCHEMBL13610448 0.73 ALDH1A1 (0.44) MEN1KMT2AALDH1A1HPGDTSHR

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 7 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-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 MEN1 2581/4885KMT2A 646/4885ALDH1A1 285/4885

“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.