SCHEMBL2963651

SCHEMBL2963651

CSCCCCCCC(=O)S

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.38
RNPEP Q9H4A4 1/20 0.35
TRPA1 O75762 4/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
CES2 O00748 3/20 0.32
CES1 P23141 3/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
NFKB1 P19838 1/20 0.32
PMP22 Q01453 1/20 0.32
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
SLC22A6 Q4U2R8 1/20 0.31
SLC22A8 Q8TCC7 1/20 0.31
GPR84 Q9NQS5 1/20 0.31

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
SCHEMBL5178444 0.79
SCHEMBL28138992 0.79 TSHR (0.47) FOLH1ALDH1A1MAPTKMT2ACES2
SCHEMBL27712598 0.79 TSHR (0.47) FOLH1ALDH1A1MAPTKMT2ACES2
SCHEMBL28065031 0.79 TSHR (0.47) FOLH1ALDH1A1MAPTKMT2ACES2
SCHEMBL24988252 0.78 PAOX (0.52) FOLH1TRPA1ALDH1A1CES2CES1
SCHEMBL849456 0.78 TSHR (0.60) FOLH1ALDH1A1KMT2ATSHRLMNA
SCHEMBL17323034 0.78 TSHR (0.60) FOLH1ALDH1A1KMT2ATSHRLMNA
SCHEMBL11413356 0.78 PAOX (0.52) FOLH1TRPA1ALDH1A1CES2CES1
SCHEMBL4003102 0.78 TSHR (0.60) FOLH1ALDH1A1KMT2ATSHRLMNA
SCHEMBL14141227 0.78 PAOX (0.52) FOLH1TRPA1ALDH1A1CES2CES1

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
US-20120145244-A1 PHOTORECEPTIVE LAYER INCLUDING HETEROGENEOUS DYES AND SOLAR CELL EMPLOYING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-06-14 US disclosed
US-20120145244-A1 PHOTORECEPTIVE LAYER INCLUDING HETEROGENEOUS DYES AND SOLAR CELL EMPLOYING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-06-14 US disclosed
US-7771769-B2 Flavouring a foodstuff by incorporating an effective amount of at least one compound of the formula R1-S-R2 in which R1 and R2 represent a specific atom or group QUEST INTERNATIONAL B.V. (NL) 2010-08-10 US disclosed
US-20100143563-A1 FLAVOURING A FOODSTUFF BY INCORPORATING AN EFFECTIVE AMOUNT OF AT LEAST ONE COMPOUND OF THE FORMULA R1-S-R2 IN WHICH R1 AND R2 REPRESENT A SPECIFIC ATOM OR GROUP QUEST INTERNATIONAL B.V. (NL) 2010-06-10 US disclosed
EP-1692952-A2 Flavouring a foodstuff with compounds containing a sulphur atom linked to two specific atoms or groups QUEST INTERNATIONAL B.V. (NL) 2006-08-23 EP disclosed
EP-1090557-B1 Savoury flavour comprising 2-methyl-furan -3-thiol and/or a derivative and methylenedithiol and/or a derivative QUEST INT (NL) 2005-09-28 EP disclosed
US-6716468-B1 MEAT FLAVORED FOODSTUFF COMPRISING COMBINATION OF AT LEAST ONE COMPOUND WITH (HYDROGENATED) 2-METHYL-3-FURYL-THIO MOIETY AND AT LEAST ONE COMPOUND WITH METHYLTHIO MOIETY QUEST INTERNATIONAL B.V. (NL) 2004-04-06 US disclosed
US-20040052914-A1 Flavouring a foodstuff by incorporating an effective amount of at least one compound of the formula r1-s-r2 in which r1 and r2 represent a specific atom or group QUEST INTERNATIONAL B.V. (NL) 2004-03-18 US disclosed
EP-1142490-A1 Flavouring a foodstuff with compounds containing a sulphur atom linked to two specific atoms or groups QUEST INTERNATIONAL B.V. (NL) 2001-10-10 EP disclosed
EP-1090557-A1 Savoury flavour comprising 2-methyl-furan -3-thiol and/or a derivative and methylenedithiol and/or a derivative QUEST INTERNATIONAL B.V. (NL) 2001-04-11 EP disclosed