SCHEMBL1060974

SCHEMBL1060974

Nc1ccccc1-c1cccs1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.56
ALDH1A1 P00352 6/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
NPC1 O15118 2/20 0.49
RAB9A P51151 1/20 0.49
ATM Q13315 1/20 0.49
TDO2 P48775 1/20 0.48
KCNH2 Q12809 1/20 0.48
LTA4H P09960 2/20 0.47
HSD17B10 Q99714 4/20 0.44
KDM4E B2RXH2 4/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 2/20 0.44
GAA P10253 1/20 0.44
TSHR P16473 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL2009428 0.88 KCNH2 (0.50) ADORA3ALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL995326 0.83 LTA4H (0.55) ADORA3ALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL15365507 0.83 TDO2 (0.46) ADORA3ALDH1A1L3MBTL1NPC1RAB9A
Hydrogen Sulfide SCHEMBL752785 0.80 LTA4H (0.53) ADORA3ALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL30187653 0.79 TDO2 (0.43) ADORA3ALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL13029774 0.79 ALDH1A1 (0.44) ADORA3ALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL28746780 0.79 TSHR (0.48) ADORA3ALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL7191737 0.79 KCNH2 (0.47) ADORA3ALDH1A1NPC1RAB9AATM
SCHEMBL16600073 0.79 KCNH2 (0.55) ADORA3ALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL6870781 0.77 KCNH2 (0.48) ADORA3ALDH1A1NPC1RAB9AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119431270-A Multi-tenor preparation method of German 南京联智医药科技有限公司 2025-02-14 CN claimed
CN-118459402-A Preparation method of quinoline derivative synthesized by palladium-zirconium bimetallic series catalysis 延安大学 2024-08-09 CN claimed
CN-118287135-A Isocyanate polymerization catalyst and preparation method thereof, polyisocyanate composition and preparation method thereof 万华化学集团股份有限公司 2024-07-05 CN claimed
CN-115433219-B Polar fluorescent probe with photodynamic property and preparation method and application thereof 徐州医科大学 2024-03-12 CN claimed
CN-117069763-A Ionic liquid catalyst and preparation method and application thereof 西安科技大学 2023-11-17 CN claimed
CN-116199551-B Soil remediation fertilizer and preparation method and application thereof 世纪云天(黑龙江)化学有限公司 2023-07-21 CN claimed
CN-116425807-A Polynuclear metal cluster compound based on salicylaldehyde amino-2-thiophenol ligand, and preparation method and application thereof 陕西师范大学 2023-07-14 CN claimed
CN-115197169-B Preparation method and application of pleuromutilin derivative with 2-aminobenzene mercapto alcohol as connecting group 华南农业大学 2023-07-11 CN claimed
CN-116239759-A Conjugated two-dimensional polymer film and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2023-06-09 CN claimed
CN-116217513-A Preparation method of 2' -substituted benzothiazole 重庆工商大学 2023-06-06 CN claimed
CN-116199551-A Soil remediation fertilizer and preparation method and application thereof 世纪云天(黑龙江)化学有限公司 2023-06-02 CN claimed
CN-115197169-A Preparation method and application of pleuromutilin derivative by taking 2-aminobenzenethiol as connecting group 华南农业大学 2022-10-18 CN claimed
WO-2021127642-A1 SELECTIVE VALORIZATION OF BIOMASS SUGARS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2021-06-24 WO claimed
CN-107643407-A A kind of magnetic immunochemiluminescence detection kit of Trenbolone and its application 北京勤邦生物技术有限公司 2018-01-30 CN claimed
EP-1807406-A2 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-18 EP claimed
WO-2006047503-A2 INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA (BE) 2006-05-04 WO claimed
US-20050113566-A1 Inhibitors of C-FMS kinase JANSSEN PHARMACEUTICA N.V. (BE) 2005-05-26 US claimed
US-6355771-B1 MODIFIED BY MERCAPTOALKYLAMINE; CORROSION RESISTANCE, ANTISCALING AGENTS NIPPON SHOKUBAI CO., LTD. (JP) 2002-03-12 US claimed
CN-120965539-A Preparation method of 22- [ (2- (L-valylamino) phenyl) ] mercapto pleuromutilin hydrochloride 华南农业大学 2025-11-18 CN disclosed
US-4242474-A A POLYHYDROXY ACRYLIC ESTER REACTED WITH AN ISOCYANATE TERMINATED POLYOXYALKYLENE GLYCOL; BIOPOLYMERS TERUMO CORPORATION (JP) 1980-12-30 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-20050113566-A1 Inhibitors of C-FMS kinase ALK, TYRO3, PDGFRB ADORA3 155/4885ALDH1A1 2507/4885L3MBTL1 2517/4885

“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.