SCHEMBL1029641

SCHEMBL1029641

Cc1ccccc1C(O)=S

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.47
ERCC5 P28715 1/20 0.45
FEN1 P39748 1/20 0.45
TSHR P16473 1/20 0.45
ACHE P22303 1/20 0.45
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
POLB P06746 2/20 0.43
KDM4E B2RXH2 2/20 0.43
MYC P01106 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
HSD17B10 Q99714 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL31135508 1.00 HPGD (0.47) HPGDERCC5FEN1TSHRACHE
Fluoride SCHEMBL27823341 0.97 HPGD (0.45) HPGDERCC5FEN1TSHRACHE
Hydrochloric Acid SCHEMBL10333053 0.97 MAOA (0.47) HPGDERCC5FEN1TSHRACHE
Naphthalene SCHEMBL27869471 0.93 HPGD (0.42) HPGDERCC5FEN1TSHRACHE
SCHEMBL7340295 0.89 HPGD (0.40) HPGDERCC5FEN1ALDH1A1SMN1; SMN2
Pyrimidine SCHEMBL27685646 0.85 TYK2 (0.41) HPGDERCC5FEN1ALDH1A1SMN1; SMN2
Trifluoromethylbenzene SCHEMBL27850540 0.84 ALDH1A1 (0.52) HPGDTSHRALDH1A1SMN1; SMN2GAA
SCHEMBL8256708 0.81 TSHR (0.47) HPGDERCC5FEN1TSHRACHE
SCHEMBL8701490 0.80 TRPA1 (0.46) HPGDTSHRALDH1A1KDM4EMYC
SCHEMBL1158061 0.80 ALDH1A1 (0.47) HPGDTSHRALDH1A1SMN1; SMN2POLB

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 194 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240336575-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-10-10 US claimed
US-20240336740-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-10-10 US claimed
US-20240327341-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-10-03 US claimed
CN-118401498-A Polythiol compound and process for producing the same 汉高股份有限及两合公司 2024-07-26 CN claimed
CN-118401566-A Polythiol compound and process for producing the same 汉高股份有限及两合公司 2024-07-26 CN claimed
EP-4198028-B1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-07-17 EP claimed
EP-4198062-B1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF HENKEL AG & CO KGAA (DE) 2024-07-17 EP claimed
CN-114874413-B Dispersing resin for cathode electrophoretic coating matched with film pretreatment and preparation method and application thereof 上海金力泰化工股份有限公司 2024-03-01 CN claimed
CN-116660543-A Diagnostic and prognostic markers for nonalcoholic fatty liver disease and uses thereof 中国人民解放军陆军军医大学第一附属医院 2023-08-29 CN claimed
CN-116622127-A Thienyl ionic liquid modified graphene heat-conducting filler and heat-conducting composite material based on same 安徽大学 2023-08-22 CN claimed
US-20140018500-A1 Polymers Functionalized With A Carboxylic Or Thiocarboxylic Ester Containing A Silylated Amino Group BRIDGESTONE CORPORATION (JP) 2014-01-16 US claimed
CN-101817770-B Method for preparing methylthio-benzoic acid UNIV JIANGSU POLYTECHNIC 2013-06-19 CN claimed
CN-101712641-B Method for preparing methylthio benzoic acid UNIV JIANGSU POLYTECHNIC 2013-05-08 CN claimed
WO-2012135451-A2 POLYMERS FUNCTIONALIZED WITH A CARBOXYLIC OR THIOCARBOXYLIC ESTER CONTAINING A SILYLATED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2012-10-04 WO claimed
CN-101817770-A Method for preparing methylthio-benzoic acid UNIV JIANGSU POLYTECHNIC 2010-09-01 CN claimed
CN-101712641-A Method for preparing methylthio benzoic acid UNIV JIANGSU POLYTECHNIC 2010-05-26 CN claimed
WO-2006091506-A2 NEUROPEPTIDE Y4 RECEPTOR AGONISTS BAYER PHARMACEUTICALS CORPORATION (US) 2006-08-31 WO claimed
EP-1349823-A1 PROCESS FOR BASE-PROMOTED CONDENSATION REACTIONS AND BASE REAGENT THEREFOR Crompton Corporation (US) 2003-10-08 EP claimed
WO-2002055466-A1 PROCESS FOR BASE-PROMOTED CONDENSATION REACTIONS AND BASE REAGENT THEREFOR CROMPTON CORPORATION (US) 2002-07-18 WO claimed
US-5466858-A Ruthenium catalyst, high selectivity with a carboxylic acid UBE INDUSTRIES, LTD. (JP) 1995-11-14 US claimed

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-20240336575-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF VRK2, VRK1, PTMS HPGD 2478/4885ERCC5 3223/4885FEN1 1519/4885
US-20240327341-A1 POLYTHIOL COMPOUNDS AND PROCESS FOR PREPARATION THEREOF VCL, C9, VRK1 HPGD 841/4885ERCC5 756/4885FEN1 391/4885

“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.