SCHEMBL120769

SCHEMBL120769

CC(=O)CC(=O)c1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLOD2 O00469 1/20 0.60
NPC1 O15118 4/20 0.57
RAB9A P51151 3/20 0.57
PTPN1 P18031 1/20 0.57
HTR7 P34969 1/20 0.55
KMT2A Q03164 6/20 0.53
MEN1 O00255 4/20 0.53
MAPT P10636 2/20 0.53
ALOX12 P18054 2/20 0.53
HTT P42858 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
HPGD P15428 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
KDM4E B2RXH2 1/20 0.47
USP2 O75604 1/20 0.47
TP53 P04637 1/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL2003577 0.89 KMT2A (0.52) PLOD2NPC1RAB9APTPN1KMT2A
SCHEMBL2491432 0.86 PLOD2 (0.69) PLOD2NPC1RAB9APTPN1HTR7
SCHEMBL3025923 0.81 NPC1 (0.67) PLOD2NPC1RAB9APTPN1HTR7
SCHEMBL30114978 0.80 PLOD2 (0.62) PLOD2NPC1RAB9APTPN1HTR7
SCHEMBL6351346 0.80 HSD17B3 (0.57) NPC1RAB9APTPN1MAPTHTT
SCHEMBL11175600 0.80 PLOD2 (0.62) PLOD2NPC1RAB9APTPN1HTR7
SCHEMBL9754092 0.80 TSHR (0.55) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL904555 0.80 PLOD2 (0.62) PLOD2NPC1RAB9APTPN1HTR7
SCHEMBL3035986 0.80 NPC1 (0.67) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL6604902 0.79 HTR7 (0.56) PLOD2NPC1RAB9APTPN1HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122054902-A Metal halide perovskite film, preparation method thereof and photovoltaic device 南京工业大学 2026-05-15 CN claimed
CN-122054902-A Metal halide perovskite film, preparation method thereof and photovoltaic device 南京工业大学 2026-05-15 CN disclosed
US-20250026762-A1 FUSED PYRAZOLE UREA ANALOGS AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2025-01-23 US disclosed
US-12116369-B2 Substituted pyrazolo[1,5-a]pyrimidines as glucocerebrosidase activators Bial—R&D Investments, S.A. (PT) 2024-10-15 US disclosed
EP-4441034-A1 FUSED PYRAZOLE UREA ANALOGS AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS Merck Sharp & Dohme LLC (US) 2024-10-09 EP disclosed
CN-118271261-A Dicarbonyl compound containing cyclobutane segment and synthesis method thereof 中国科学技术大学 2024-07-02 CN disclosed
US-20230348492-A1 PHOTOCHEMICAL SYNTHESIS OF MARMYCIN ANALOGUES THROUGH A NEW PHOTOCHEMICAL REACTION INVOLVING CARBONYL COMPOUNDS BOWLING GREEN STATE UNIVERSITY (US) 2023-11-02 US disclosed
US-20230348492-A1 PHOTOCHEMICAL SYNTHESIS OF MARMYCIN ANALOGUES THROUGH A NEW PHOTOCHEMICAL REACTION INVOLVING CARBONYL COMPOUNDS BOWLING GREEN STATE UNIVERSITY (US) 2023-11-02 US disclosed
WO-2023101895-A1 FUSED PYRAZOLE UREA ANALOGS AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2023-06-08 WO disclosed
US-20230098494-A1 PYRAZOLO[1,5-a]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS LYSOSOMAL THERAPEUTICS INC. 2023-03-30 US disclosed
EP-0168037-B1 1-6-NAPHTHYRIDIN-2(1H)-ONES USEFUL AS CARDIOTONICS STERLING DRUG INC. (US) 1990-02-07 EP disclosed
US-4668799-A Anti-hepatitis and anti-cirrhotic 1,3-dithiol-2-ylidene derivatives, and pharmaceutical compositions therefor BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-05-26 US disclosed
EP-0210284-A1 1,3-Dithiol-2-ylidene derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-02-04 EP disclosed
EP-0168037-A2 1-6-Naphthyridin-2(1H)-ones useful as cardiotonics STERLING DRUG INC. (US) 1986-01-15 EP disclosed
US-4560691-A 5-(Phenyl)-1,6-naphthyridin-2(1H)-ones, their cardiotonic use and preparation STERLING DRUG INC. (US) 1985-12-24 US disclosed
EP-0049486-B1 METAL COMPLEXES FOR USE IN THE TREATMENT OF CANCER Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1985-09-18 EP disclosed
EP-0016277-B1 2-CARBONYL-3-HYDROXY-ALKENONITRILES, THEIR USE AS ANTI-ARTHRITIC AGENTS AND PROCESSES FOR THEIR PREPARATION AMERICAN CYANAMID COMPANY (US) 1981-12-02 EP disclosed
EP-0016277-A1 2-Carbonyl-3-hydroxy-alkenonitriles, their use as anti-arthritic agents and processes for their preparation AMERICAN CYANAMID COMPANY (US) 1980-10-01 EP disclosed
WO-1980000964-A1 ANTI-INFLAMMATORY AGENTS INCLUDING 2-CARBONYL-3-HYDROXY-2-ALKENONITRILES AMERICAN CYANAMID CO (US) 1980-05-15 WO disclosed
US-4173650-A ANTIARTHRITIC AGENTS AMERICAN CYANAMID COMPANY (US) 1979-11-06 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 (4 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-12116369-B2 Substituted pyrazolo[1,5-a]pyrimidines as glucocerebrosidase activators GBA1, GALC, GBA3 PLOD2 1532/4885NPC1 846/4885RAB9A 806/4885
US-20230098494-A1 PYRAZOLO[1,5-a]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GAA, PARK7 PLOD2 1334/4885NPC1 851/4885RAB9A 1599/4885
US-20230348492-A1 PHOTOCHEMICAL SYNTHESIS OF MARMYCIN ANALOGUES THROUGH A NEW PHOTOCHEMICAL REACTION INVOLVING CARBONYL COMPOUNDS HCCS, MYCBP, CYC1 PLOD2 2922/4885NPC1 3763/4885RAB9A 2866/4885
US-20250026762-A1 FUSED PYRAZOLE UREA ANALOGS AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, UGCG PLOD2 3480/4885NPC1 63/4885RAB9A 720/4885

“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.