SCHEMBL1020142

SCHEMBL1020142

COc1cc(F)ccc1C(C)=O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
HTT P42858 1/20 0.48
LMNA P02545 3/20 0.47
ALDH1A1 P00352 4/20 0.47
KMT2A Q03164 2/20 0.47
CTSL P07711 1/20 0.47
CYP3A4 P08684 2/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.46
CA9 Q16790 1/20 0.45
CLK1 P49759 1/20 0.45
KDM4E B2RXH2 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PKM P14618 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 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
SCHEMBL30134039 1.00 SMN1; SMN2 (0.49) SMN1; SMN2NPC1RAB9AHTTLMNA
SCHEMBL31345946 0.87 CES2 (0.44) SMN1; SMN2NPC1RAB9AHTTLMNA
SCHEMBL27709578 0.86 NPC1 (0.51) SMN1; SMN2NPC1RAB9AHTTLMNA
SCHEMBL43492 0.85 PIN1 (0.49) SMN1; SMN2NPC1RAB9AHTTLMNA
SCHEMBL30675620 0.85 ALDH1A1 (0.62) SMN1; SMN2NPC1RAB9AHTTLMNA
SCHEMBL927338 0.85 ALDH1A1 (0.62) SMN1; SMN2NPC1RAB9AHTTLMNA
SCHEMBL1146881 0.83 FFAR4 (0.55) SMN1; SMN2NPC1RAB9AHTTLMNA
Hydrochloric Acid SCHEMBL10990786 0.83 ALDH1A1 (0.61) SMN1; SMN2NPC1RAB9AHTTLMNA
SCHEMBL3337842 0.83 PARP10 (0.52) SMN1; SMN2NPC1RAB9AHTTLMNA
SCHEMBL2336567 0.83 SMN1; SMN2 (0.48) SMN1; SMN2NPC1RAB9AHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240300951-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-09-12 US disclosed
US-20240270751-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-08-15 US disclosed
CN-115088722-B Application, method and composition of diphenyl ether compound containing triazole structure in preventing and controlling plant diseases 海利尔药业集团股份有限公司 2024-06-21 CN disclosed
CN-117836296-A Pyrazolopyridone compounds 百济神州有限公司 2024-04-05 CN disclosed
CN-114805224-B Ligustrazine chalcone derivative and preparation method and application thereof 山东大学 2024-03-22 CN disclosed
CN-117177970-A Polycyclic derivative regulator, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-12-05 CN disclosed
US-11786524-B2 Pharmaceutical compounds SENTINEL ONCOLOGY LIMITED (GB) 2023-10-17 US disclosed
CN-109942523-B Benzofuran and benzofuran coumarin derivatives, and preparation method and application thereof 华东师范大学 2023-06-09 CN disclosed
WO-2023082898-A1 DIVALENT PLATINUM COMPLEX HAVING HIGH COLOR PURITY 广东阿格蕾雅光电材料有限公司 2023-05-19 WO disclosed
WO-2022228490-A1 POLYCYCLIC DERIVATIVE MODULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2022-11-03 WO disclosed
EP-1068184-A1 N-ARYLOXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AMERICAN HOME PRODUCTS CORPORATION (US) 2001-01-17 EP disclosed
US-6110956-A ANTIDEPRESSANTS TREATING DISORDERS OF THE SEROTONIN-AFFECTED NEUROLOGICAL SYSTEMS AMERICAN HOME PRODUCTS CORP. (US) 2000-08-29 US disclosed
WO-1999051576-A1 N-ARYLOXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF DEPRESSION AMERICAN HOME PRODUCTS CORPORATION (US) 1999-10-14 WO disclosed
US-4670445-A VASODILATORS ELI LILLY AND COMPANY (US) 1987-06-02 US disclosed
EP-0113236-B1 SUBSTITUTED IMIDAZOPYRIMIDINES-PYRAZINES, AND -TRIAZINES ELI LILLY AND COMPANY (US) 1987-04-22 EP disclosed
US-4636502-A Methods of producing a positive inotropic effect or vasodilation by administration of 2-phenyl imidazo pyrimidines and pyrazines ELI LILLY AND COMPANY (US) 1987-01-13 US disclosed
US-4578387-A VASODILATION; DERIVATIVES OF 2-PHENYL-5,6,7,8-TETRAHYDROIMADAZO/1,2-A/PYRAZINE ELI LILLY AND COMPANY (US) 1986-03-25 US disclosed
EP-0154494-A2 Phenylimidazole inotropic agents ELI LILLY AND COMPANY (US) 1985-09-11 EP disclosed
US-4537889-A PHENYL SUBSTITUTED IMIDAZO COMPOUNDS ELI LILLY AND COMPANY (US) 1985-08-27 US disclosed
EP-0113236-A1 Substituted imidazopyrimidines-pyrazines, and -triazines ELI LILLY AND COMPANY (US) 1984-07-11 EP 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-20240300951-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK SMN1; SMN2 2823/4885NPC1 2052/4885RAB9A 981/4885
US-11786524-B2 Pharmaceutical compounds CHKA, CHKB, TNK2 SMN1; SMN2 3349/4885NPC1 306/4885RAB9A 1682/4885
US-20240270751-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK SMN1; SMN2 2823/4885NPC1 2052/4885RAB9A 981/4885

“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.