SCHEMBL632848

SCHEMBL632848

CC(C)(C)OC(=O)Nc1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
NPC1 O15118 4/20 0.54
RAB9A P51151 4/20 0.54
MAPT P10636 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MAPK1 P28482 2/20 0.54
HTT P42858 2/20 0.54
XBP1 P17861 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CYP17A1 P05093 2/20 0.52
ALDH1A1 P00352 3/20 0.50
PSMB8 P28062 1/20 0.50
LMNA P02545 1/20 0.50
ALOX12 P18054 1/20 0.50
NAMPT P43490 1/20 0.50
FAAH O00519 1/20 0.48
ATM Q13315 1/20 0.47
POLB P06746 1/20 0.47
CA12 O43570 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
SCHEMBL7080560 0.91 NAMPT (0.64) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL13055402 0.90 CYP17A1 (0.59) SMN1; SMN2L3MBTL1CYP17A1ALDH1A1PSMB8
SCHEMBL22548863 0.88 CYP17A1 (0.57) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL15996891 0.87 SMN1; SMN2 (0.53) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL22548789 0.85 CYP17A1 (0.51) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL23619661 0.85 SMN1; SMN2 (0.62) NPC1RAB9AMAPTSMN1; SMN2L3MBTL1
SCHEMBL20865536 0.85 CYP17A1 (0.68) SMN1; SMN2HTTL3MBTL1CYP17A1PSMB8
SCHEMBL22804523 0.84 CA12 (0.47) NPC1RAB9AMAPTSMN1; SMN2CYP17A1
SCHEMBL29811040 0.84 CA12 (0.47) NPC1RAB9AMAPTSMN1; SMN2CYP17A1
SCHEMBL15996917 0.83 NPC1 (0.53) NPC1RAB9AMAPTSMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025054616-A1 PLATFORM APPROACH F-18 RADIOLABELING OF VARIOUS PEPTIDES IN AQUEOUS MEDIUM MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2025-03-13 WO disclosed
CN-118666725-A Compound with antibacterial activity, preparation method thereof and antibacterial agent 西华大学 2024-09-20 CN disclosed
WO-2024147972-A2 DNA POLYMERASE THETA INHIBITORS CONTAINING NON-SATURATED 5-MEMBERED HETEROCYCLIC RINGS AND USE THEREOF THOMAS JEFFERSON UNIVERSITY (US) 2024-07-11 WO disclosed
WO-2024147972-A2 DNA POLYMERASE THETA INHIBITORS CONTAINING NON-SATURATED 5-MEMBERED HETEROCYCLIC RINGS AND USE THEREOF THOMAS JEFFERSON UNIVERSITY (US) 2024-07-11 WO disclosed
CN-117800975-A Compounds with anti-KRAS mutant tumor activity 泰励生物科技(上海)有限公司 2024-04-02 CN disclosed
CN-116867779-A KRAS inhibitors for cancer treatment 泰励生物科技(上海)有限公司 2023-10-10 CN disclosed
CN-116096710-A 4-oxo-3, 4-dihydroquinazolinone compounds for the treatment of BRAF related diseases and disorders 阿雷生物药品公司 2023-05-09 CN disclosed
US-20220289720-A1 ARYL SULFONAMIDES AS SMALL MOLECULE STAT3 INHIBITORS UNIVERSITY OF HAWAII 2022-09-15 US disclosed
CN-115043788-A Trifluoromethyl oxazole-2-ketone compound and preparation method and application thereof 南京工业大学 2022-09-13 CN disclosed
CN-114920738-A KRas inhibitors for cancer treatment 泰励生物科技(上海)有限公司 2022-08-19 CN disclosed
US-20040248887-A1 Inhibitors of cathepsin S IRM LLC (BM) 2004-12-09 US disclosed
WO-2004084843-A2 INHIBITORS OF CATHEPSIN S IRM LLC (BM) 2004-10-07 WO disclosed
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-06-24 US disclosed
WO-2004002481-A1 ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS NOVO NORDISK A/S (DK) 2004-01-08 WO disclosed
CN-1426405-A Novel cyclic amide derivative MITSUBISHI PHARMACEUTICALS INC (JP) 2003-06-25 CN disclosed
WO-1996016980-A1 MORPHOLINOETHYLAMIDE DERIVATIVES NOVARTIS AG (CH) 1996-06-06 WO disclosed
EP-0065864-B1 ANTI-HYPERTENSIVE 1-SUBSTITUTED SPIRO (PIPERIDINE-OXOBENZOXAZINES) SYNTEX (U.S.A.) INC. (US) 1985-08-28 EP disclosed
EP-0065864-A1 Anti-hypertensive 1-substituted spiro (piperidine-oxobenzoxazines) SYNTEX (U.S.A.) INC. (US) 1982-12-01 EP disclosed
US-4349549-A Anti-hypertensive 1-substituted spiro(piperidine-oxobenzoxazine)s SYNTEX (U.S.A.) INC. (US) 1982-09-14 US disclosed
EP-0030845-A2 Pharmacologically active peptides, their preparation and pharmaceutical compositions containing them ELI LILLY AND COMPANY (US) 1981-06-24 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-20040248887-A1 Inhibitors of cathepsin S CTSS, CTSB, CTSZ MEN1 3815/4885KMT2A 4282/4885NPC1 82/4885
US-20220289720-A1 ARYL SULFONAMIDES AS SMALL MOLECULE STAT3 INHIBITORS STAT3, JAK2, STAT6 MEN1 4749/4885KMT2A 611/4885NPC1 1883/4885
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 MEN1 4426/4885KMT2A 1526/4885NPC1 2201/4885

“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.