SCHEMBL369102

SCHEMBL369102

CCCCCc1cc(CCCCC)on1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.71
KCNH2 Q12809 1/20 0.42
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.38
RIPK1 Q13546 1/20 0.36
CYP3A4 P08684 1/20 0.35
PTGS2 P35354 1/20 0.35
MAPT P10636 1/20 0.35
MIF P14174 1/20 0.35
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 2/20 0.35
TSHR P16473 1/20 0.35
XBP1 P17861 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL2093939 0.91 PPARA (0.62) PPARAKCNH2NPC1RAB9ASMN1; SMN2
SCHEMBL3812770 0.90 PPARA (0.65) PPARAKCNH2NPC1RAB9ASMN1; SMN2
SCHEMBL1221911 0.87 PPARA (0.61) PPARAKCNH2NPC1RAB9ASMN1; SMN2
SCHEMBL8605589 0.87 PPARA (0.57) PPARAKCNH2NPC1RAB9ASMN1; SMN2
SCHEMBL8605187 0.87 PPARA (0.57) PPARAKCNH2NPC1RAB9ASMN1; SMN2
SCHEMBL7686496 0.85 PPARA (0.64) PPARAKCNH2NPC1RAB9ASMN1; SMN2
SCHEMBL7502255 0.85 PPARA (0.60) PPARAKCNH2NPC1RAB9ASMN1; SMN2
SCHEMBL27880443 0.85 PPARA (0.60) PPARAKCNH2NPC1RAB9ASMN1; SMN2
SCHEMBL7505230 0.85 PPARA (0.64) PPARAKCNH2NPC1RAB9ASMN1; SMN2
SCHEMBL25801694 0.85 PPARA (0.64) PPARAKCNH2NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4384013-A1 PROTEIN AGGREGATION INHIBITING COMPOUNDS FOR PLANT DISEASE CONTROL MAX-PLANCK-GESELLSCHAFT ZUR FÖRDERUNG DER WISSENSCHAFTEN E.V. (DE) 2024-06-19 EP disclosed
WO-2023073115-A1 PROTEIN AGGREGATION INHIBITING COMPOUNDS FOR PLANT DISEASE CONTROL MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2023-05-04 WO disclosed
EP-4173485-A1 PROTEIN AGGREGATION INHIBITING COMPOUNDS FOR PLANT DISEASE CONTROL Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2023-05-03 EP disclosed
CN-107108527-B Ataxia telangiectasia and Rad 3-Associated (ATR) protein kinase inhibitors 阿特林制药有限责任公司 2022-08-02 CN disclosed
EP-3207031-B1 ATAXIA TELENGIECTASIA AND RAD3-RELATED (ATR) PROTEIN KINASE INHIBITORS Atrin Pharmaceuticals LLC (US) 2021-04-14 EP disclosed
US-10308638-B2 Selective alpha-7 nicotinic receptor agonists and methods for making and using them THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-06-04 US disclosed
US-10196405-B2 Ataxia telengiectasia and Rad3-related (ATR) protein kinase inhibitors Atrin Pharmaceuticals LLC (US) 2019-02-05 US disclosed
US-20180244653-A1 SELECTIVE ALPHA-7 NICOTINIC RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-08-30 US disclosed
US-9981989-B2 Ataxia telengiectasia and Rad3-related (ATR) protein kinase inhibitors Atrin Pharmaceuticals LLC (US) 2018-05-29 US disclosed
CN-107108527-A Ataxia telangiectasia and Rad 3-Associated (ATR) protein kinase inhibitors 阿特林制药有限责任公司 2017-08-29 CN disclosed
WO-2010062264-A1 LIPOPEPTIDE COMPOUNDS AND THEIR USE MERLION PHARMACEUTICALS PTE LTD (SG) 2010-06-03 WO disclosed
US-20090170720-A1 MOLECULAR TARGETS AND COMPOUNDS, AND METHODS TO IDENTIFY THE SAME, USEFUL IN THE TREATMENT OF JOINT DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2009-07-02 US disclosed
CN-100497345-C 2, 3-dihydro-6-nitroimidazolo [2,1-b] oxazole compounds for the treatment of tuberculosis OTSUKA PHARMA CO LTD (JP) 2009-06-10 CN disclosed
US-7485468-B2 Drug screening for inhibititors of extracellular matrix (ECM) degradation and inflammation using polypeptide and fragments, expression inhibitory agents such as antisense polynucleotide, a ribozyme, and a small interfering RNA; measuring binding affinity; arthritis; matrix metalloprotease, cathepsin GALAPAGOS BV (BE) 2009-02-03 US disclosed
EP-1817411-A2 MOLECULAR TARGETS AND COMPOUNDS, AND METHODS TO IDENTIFY THE SAME, USEFUL IN THE TREATMENT OF JOINT DEGENERATIVE AND INFLAMMATORY DISEASES Galapagos N.V. (BE) 2007-08-15 EP disclosed
US-7052742-B1 Five membered-ring compounds and utilization thereof in liquid crystal mixtures CLARIANT INTERNATIONAL LTD. (CH) 2006-05-30 US disclosed
US-20060094061-A1 Drug screening for inhibititors of extracellular matrix (ECM) degradation and inflammation using polypeptide and fragments, expression inhibitory agents such as antisense polynucleotide, a ribozyme, and a small interfering RNA; measuring binding affinity; arthritis; matrix metalloprotease, cathepsin GALAPAGOS N.V. (BE) 2006-05-04 US disclosed
WO-2006040357-A2 MOLECULAR TARGETS AND COMPOUNDS, AND METHODS TO IDENTIFY THE SAME, USEFUL IN THE TREATMENT OF JOINT DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2006-04-20 WO disclosed
EP-1214316-A1 FIVE MEMBERED-RING COMPOUNDS AND UTILIZATION THEREOF IN LIQUID CRYSTAL MIXTURES CLARIANT INTERNATIONAL LTD. (CH) 2002-06-19 EP disclosed
WO-2001016131-A2 FIVE MEMBERED-RING COMPOUNDS AND UTILIZATION THEREOF IN LIQUID CRYSTAL MIXTURES CLARIANT INTERNATIONAL LTD (CH) 2001-03-08 WO 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-10308638-B2 Selective alpha-7 nicotinic receptor agonists and methods for making and using them CHRNA7, CHRNA1, CHRNA5 PPARA 1523/4885KCNH2 224/4885NPC1 2067/4885
US-10196405-B2 Ataxia telengiectasia and Rad3-related (ATR) protein kinase inhibitors CHEK2, ATR, CHEK1 PPARA 3744/4885KCNH2 2277/4885NPC1 4202/4885
US-20180244653-A1 SELECTIVE ALPHA-7 NICOTINIC RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM CHRNA7, CHRNA1, CHRNA5 PPARA 1523/4885KCNH2 224/4885NPC1 2067/4885

“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.