SCHEMBL6842459

SCHEMBL6842459

CCOc1nc2ccccc2s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 6/20 0.58
PTGS2 P35354 6/20 0.58
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
F2RL3 Q96RI0 1/20 0.56
NPC1 O15118 4/20 0.50
MAPT P10636 3/20 0.50
KDM4E B2RXH2 2/20 0.50
GLA P06280 1/20 0.50
PPARG P37231 2/20 0.48
PPARA Q07869 2/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
RAB9A P51151 3/20 0.48
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
FBP1 P09467 1/20 0.47
GAA P10253 1/20 0.47
PKM P14618 1/20 0.46
UBE2T Q9NPD8 1/20 0.46
ASIC3 Q9UHC3 1/20 0.46

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
SCHEMBL10158221 0.86 PTGS1 (0.61) PTGS1PTGS2KMT2AMEN1NPC1
SCHEMBL12110104 0.85 PTGS1 (0.65) PTGS1PTGS2KMT2AMEN1F2RL3
SCHEMBL9167195 0.84 PTGS1 (0.64) PTGS1PTGS2KMT2AMEN1NPC1
SCHEMBL28282484 0.83 PTGS1 (0.58) PTGS1PTGS2KMT2AMEN1NPC1
SCHEMBL30423366 0.82 PTGS1 (0.57) PTGS1PTGS2KMT2AMEN1NPC1
SCHEMBL12371895 0.82 PTGS1 (0.57) PTGS1PTGS2KMT2AMEN1NPC1
SCHEMBL30423741 0.82 PTGS1 (0.57) PTGS1PTGS2KMT2AMEN1NPC1
SCHEMBL12371894 0.82 PTGS1 (0.57) PTGS1PTGS2KMT2AMEN1NPC1
SCHEMBL7352333 0.81 PTGS1 (0.62) PTGS1PTGS2KMT2AMEN1NPC1
SCHEMBL1632866 0.81 PTGS1 (0.58) PTGS1PTGS2KMT2AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2271650-B1 Quinuclidine compounds as alpha-7 nicotinic acetylcholine receptor ligands BRISTOL MYERS SQUIBB CO (US) 2015-09-16 EP claimed
EP-2493893-B1 AZABICYCLO[2.2.1]HEPTANE COMPOUNDS AS ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS BRISTOL MYERS SQUIBB CO (US) 2014-01-15 EP claimed
US-4225705-A QUATERNIZATION OF A BENZOTHIAZOLE, CONDENSED WITH A BENZOTHIAZOLIUM BETAINE BADER HENRY 1980-09-30 US claimed
CN-116730948-A Method for synthesizing N-cyclohexyl-2-benzothiazole 圣奥化学科技有限公司 2023-09-12 CN disclosed
US-10945996-B2 Inhibiting germination of clostridium perfringens spores to reduce necrotic enteritis THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS (US) 2021-03-16 US disclosed
US-20190209531-A1 Inhibiting Germination of Clostridium Perfringens Spores to Reduce Necrotic Enteritis THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2019-07-11 US disclosed
CN-106632304-B A kind of two-photon RNA fluorescence probe and its application in living cells imaging 山东省科学院新材料研究所 2019-03-26 CN disclosed
US-20180000793-A1 Inhibiting Germination of Clostridium Perfringens Spores to Reduce Necrotic Enteritis ABEL-SANTOS ERNESTO (US) 2018-01-04 US disclosed
US-20170190923-A1 NEAR-INFRARED ABSORPTION COMPOSITION, CURABLE COMPOSITION, CURED FILM, NEAR-INFRARED CUT FILTER, SOLID-STATE IMAGING DEVICE, INFRARED SENSOR, CAMERA MODULE, PROCESSED COLORING AGENT, AND METHOD OF MANUFACTURING PROCESSED COLORING AGENT FUJIFILM CORPORATION (JP) 2017-07-06 US disclosed
US-20170190923-A1 NEAR-INFRARED ABSORPTION COMPOSITION, CURABLE COMPOSITION, CURED FILM, NEAR-INFRARED CUT FILTER, SOLID-STATE IMAGING DEVICE, INFRARED SENSOR, CAMERA MODULE, PROCESSED COLORING AGENT, AND METHOD OF MANUFACTURING PROCESSED COLORING AGENT FUJIFILM CORPORATION (JP) 2017-07-06 US disclosed
EP-2739612-B1 COMPOUNDS AND COMPOSITIONS FOR USE IN AUGMENTATION OF GLUCOSE UPTAKE AND INSULIN SECRETION YISSUM RES DEV CO (IL) 2017-06-21 EP disclosed
EP-0985674-B1 ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR ALPHA-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING ALPHA-OLEFIN POLYMERS MITSUBISHI CHEM CORP (JP) 2003-04-23 EP disclosed
US-6255515-B1 COORDINATION POLYMERIZATION CATALYSTS MITSUBISHI CHEMICAL CORPORATION (JP) 2001-07-03 US disclosed
EP-0985674-A1 ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR $g(a)-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING $g(a)-OLEFIN POLYMERS MITSUBISHI CHEMICAL CORPORATION (JP) 2000-03-15 EP disclosed
WO-1996035422-A1 METHODS FOR INHIBITING BONE LOSS ELI LILLY AND COMPANY (US) 1996-11-14 WO disclosed
US-5166042-A Multilayer color photographic member FUJI PHOTO FILM CO., LTD. (JP) 1992-11-24 US disclosed
EP-0357082-A2 Silver halide photographic emulsions FUJI PHOTO FILM CO., LTD. (JP) 1990-03-07 EP disclosed
US-4225705-A QUATERNIZATION OF A BENZOTHIAZOLE, CONDENSED WITH A BENZOTHIAZOLIUM BETAINE BADER HENRY 1980-09-30 US disclosed
US-4201707-A Methine dyestuffs containing a phenyl azo group BAYER AKTIENGESELLSCHAFT (DE) 1980-05-06 US disclosed
US-4138570-A METHINE DYE BAYER AKTIENGESELLSCHAFT (DE) 1979-02-06 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 (3 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-10945996-B2 Inhibiting germination of clostridium perfringens spores to reduce necrotic enteritis CASP3, SI, PYCARD PTGS1 521/4885PTGS2 638/4885KMT2A 4855/4885
US-20190209531-A1 Inhibiting Germination of Clostridium Perfringens Spores to Reduce Necrotic Enteritis CASP3, SI, PYCARD PTGS1 521/4885PTGS2 638/4885KMT2A 4855/4885
US-20180000793-A1 Inhibiting Germination of Clostridium Perfringens Spores to Reduce Necrotic Enteritis CASP3, SI, PYCARD PTGS1 521/4885PTGS2 638/4885KMT2A 4855/4885

“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.