SCHEMBL1110091

SCHEMBL1110091

CCOC(=O)CC(=O)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.62
MEN1 O00255 3/20 0.62
HTT P42858 2/20 0.62
GAA P10253 1/20 0.58
ATM Q13315 1/20 0.55
ALDH1A1 P00352 4/20 0.55
AGTR1 P30556 3/20 0.55
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
MAPT P10636 2/20 0.53
G6PD P11413 1/20 0.53
IRAK1 P51617 1/20 0.53
IRAK4 Q9NWZ3 1/20 0.53
TP53 P04637 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.52
MAPK1 P28482 1/20 0.52

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
SCHEMBL28712212 0.88 GAA (0.63) KMT2AMEN1HTTGAAATM
SCHEMBL10539201 0.87 KMT2A (0.62) KMT2AMEN1HTTALDH1A1AGTR1
SCHEMBL11673189 0.87 ALDH1A1 (0.54) KMT2AMEN1HTTGAAALDH1A1
SCHEMBL6158148 0.87 KMT2A (0.57) KMT2AMEN1HTTGAAATM
SCHEMBL28852443 0.85 NPC1 (0.55) KMT2AMEN1HTTGAAALDH1A1
Malonic Acid Diethyl Ester SCHEMBL27871201 0.85 MEN1 (0.58) KMT2AMEN1HTTGAAATM
SCHEMBL10806282 0.83 ATM (0.55) KMT2AMEN1HTTGAAATM
SCHEMBL11760069 0.83 ALDH1A1 (0.51) KMT2AMEN1HTTALDH1A1AGTR1
SCHEMBL276340 0.82 LMNA (0.59) KMT2AMEN1GAAALDH1A1MAPT
SCHEMBL3388760 0.82 NPC1 (0.62) KMT2AMEN1HTTGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101429183-A 2H-1-benzopyran-2-ketone compounds with alpha-glucosidase inhibit activity, its composition and preparation method thereof UNIV SHENYANG PHARMACEUTICAL (CN) 2009-05-13 CN claimed
US-12637436-B2 Metabotropic glutamate receptor negative allosteric modulators (NAMs) and uses thereof Sanford Burnham Prebys Medical Discovery Institute (US) 2026-05-26 US disclosed
US-20250230147-A1 LACTAMS AS CBL-B INHIBITORS GENENTECH, INC. (US) 2025-07-17 US disclosed
EP-4563572-A1 PYRAZOLONE COMPOUND AND PYRAZOLONE AGENT The Noguchi Institute (JP) 2025-06-04 EP disclosed
US-20250129030-A1 PYRAZOLONE COMPOUND AND PYRAZOLONE AGENT THE NOGUCHI INSTITUTE (JP) 2025-04-24 US disclosed
WO-2024024760-A1 PYRAZOLONE COMPOUND AND PYRAZOLONE AGENT 公益財団法人野口研究所 2024-02-01 WO disclosed
EP-4288429-A1 LACTAMS AS CBL-B INHIBITORS Genentech, Inc. (US) 2023-12-13 EP disclosed
CN-116888112-A Lactams as CBL-B inhibitors 基因泰克公司 2023-10-13 CN disclosed
US-20230113588-A1 METABOTROPIC GLUTAMATE RECEPTOR NEGATIVE ALLOSTERIC MODULATORS (NAMS) AND USES THEREOF Sanford Burnham Prebys Medical Discovery Institute 2023-04-13 US disclosed
US-20230079990-A1 LACTAMS AS CBL-B INHIBITORS GENENTECH, INC. (US) 2023-03-16 US disclosed
EP-0946528-A2 OXYGEN OR SULFUR CONTAINING 5-MEMBERED HETEROAROMATICS AS FACTOR Xa INHIBITORS Du Pont Pharmaceuticals Company (US) 1999-10-06 EP disclosed
WO-1998028282-A2 OXYGEN OR SULFUR CONTAINING 5-MEMBERED HETEROAROMATICS AS FACTOR Xa INHIBITORS DU PONT PHARMACEUTICALS COMPANY (US) 1998-07-02 WO disclosed
EP-0620818-A1 ARYL KETONES AS TESTOSTERONE 5$g(a)-REDUCTASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-10-26 EP disclosed
WO-1993013099-A1 ARYL KETONES AS TESTOSTERONE 5α-REDUCTASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-07-08 WO disclosed
US-4692447-A HYPOTENSIVE, VASODILATOR, ANTITHROMBOTIC, ANTIAGGREGANT, CYTOPROTECTIVE BOEHRINGER BIOCHEMIA ROBIN, S.P.A. (IT) 1987-09-08 US disclosed
EP-0169443-A2 Tricyclic dihydropyridazinones and pharmaceutical compositions contaning them BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1986-01-29 EP disclosed
EP-0015602-B1 NOVEL LIGHT-ABSORBING METHINE DYES AND PHOTOGRAPHIC MATERIALS CONTAINING THEM AGFA-GEVAERT N.V. (BE) 1983-09-21 EP disclosed
US-4266014-A Photographic materials containing light absorbing methine dyes AGFA-GEVAERT N.V. (BE) 1981-05-05 US disclosed
EP-0015602-A1 Novel light-absorbing methine dyes and photographic materials containing them AGFA-GEVAERT N.V. (BE) 1980-09-17 EP disclosed
US-4041158-A INSECTICIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-08-09 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 (5 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-20250230147-A1 LACTAMS AS CBL-B INHIBITORS CBLB, CBL, CBLC KMT2A 1976/4885MEN1 2646/4885HTT 4101/4885
US-20230113588-A1 METABOTROPIC GLUTAMATE RECEPTOR NEGATIVE ALLOSTERIC MODULATORS (NAMS) AND USES THEREOF GRM3, GRM2, GRM1 KMT2A 942/4885MEN1 2740/4885HTT 1571/4885
US-20230079990-A1 LACTAMS AS CBL-B INHIBITORS CBLB, CBL, CBLC KMT2A 1976/4885MEN1 2646/4885HTT 4101/4885
US-20250129030-A1 PYRAZOLONE COMPOUND AND PYRAZOLONE AGENT NPM1, PLK3, PKN2 KMT2A 3718/4885MEN1 3460/4885HTT 2453/4885
US-12637436-B2 Metabotropic glutamate receptor negative allosteric modulators (NAMs) and uses thereof GRM3, GRM2, GRM1 KMT2A 1325/4885MEN1 2193/4885HTT 2076/4885

“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.