SCHEMBL6299586

SCHEMBL6299586

NC1=c2ccccc2=NC(=O)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.39
KMT2A Q03164 7/20 0.39
ALDH1A1 P00352 6/20 0.39
MEN1 O00255 6/20 0.39
POLB P06746 6/20 0.39
LMNA P02545 4/20 0.39
NPSR1 Q6W5P4 3/20 0.39
PKM P14618 1/20 0.39
MAPK10 P53779 1/20 0.39
CCR6 P51684 1/20 0.39
TGM2 P21980 1/20 0.38
ATM Q13315 1/20 0.36
MAPK1 P28482 3/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA9 Q16790 3/20 0.34
MGAM O43451 2/20 0.34
CA12 O43570 2/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33

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
SCHEMBL1137916 0.89 MAPT (0.40) MAPTKMT2AALDH1A1MEN1POLB
Hydrochloric Acid SCHEMBL28409932 0.87 MAPT (0.39) MAPTKMT2AALDH1A1MEN1POLB
SCHEMBL29161382 0.75 MAPT (0.54) MAPTKMT2AALDH1A1MEN1POLB
SCHEMBL6866011 0.74 IDO1 (0.39) MAPTKMT2AALDH1A1MEN1POLB
SCHEMBL10908259 0.73 NPC1 (0.42) MAPTKMT2AALDH1A1MEN1POLB
Isatin SCHEMBL7073534 0.71 MAPT (0.47) MAPTKMT2AALDH1A1MEN1POLB
SCHEMBL5855550 0.71 MAPT (0.40) MAPTKMT2AALDH1A1MEN1POLB
SCHEMBL9139763 0.71 ATM (0.41) MAPTKMT2AALDH1A1MEN1POLB
SCHEMBL31513845 0.71 ALDH1A1 (0.30) MAPTALDH1A1NPSR1PKMMAPK10
SCHEMBL6866868 0.71 MAPT (0.43) MAPTKMT2AALDH1A1MEN1POLB

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12331032-B2 Quinone reductase 2 inhibitor compounds and uses thereof DUKE UNIVERSITY (US) 2025-06-17 US disclosed
CN-112867711-B Quinone reductase 2 inhibitor compounds and uses thereof 杜克大学 2025-02-18 CN disclosed
JP-2025003966-A Quinone reductase 2 inhibitor compounds and uses thereof デューク・ユニヴァーシティ 2025-01-14 JP disclosed
EP-3867239-B1 QUINONE REDUCTASE 2 INHIBITOR COMPOUNDS AND USES THEREOF UNIV DUKE (US) 2024-12-04 EP disclosed
CN-112823006-B Quinone reductase 2 inhibitors as neuroprotective agents 杜克大学 2024-09-17 CN disclosed
EP-3866802-B1 QUINONE REDUCTASE 2 INHIBITORS FOR USE AS NEUROPROTECTIVE AGENTS UNIV DUKE (US) 2024-08-21 EP disclosed
US-11351275-B2 Metal complexes with bisphophonate or pyrophosphate useful as imaging agents DUKE UNIVERSITY (US) 2022-06-07 US disclosed
US-6841555-B2 Lavendamycin analogs, quinoline-5,8-diones and methods of using them BALL STATE UNIVERSITY (US) 2005-01-11 US disclosed
US-20040248922-A1 LAVENDAMYCIN ANALOGS, QUINOLINE-5,8-DIONES AND METHODS OF USING THEM BALL STATE UNIVERSITY 2004-12-09 US disclosed
US-6444684-B1 ANTIBIOTIC AND ANTI-HIV REVERSE TRANSCRIPTASE (HIV-RT) ACTIVITY; TREATING HIV INFECTION AND ALSO WITH AZT; ANTITUMOR BALL STATE UNIVERSITY 2002-09-03 US disclosed
US-6030983-A ANTITUMOR AND -CARCINOGENIC AGENTS; ANTIBIOTICS; BACTERICIDES; VIRICIDES; PARACITICIDES; ENZYME INHIBITORS; POLYMERASES; FARNESYL-PROTEIN TRANSFERASE; RAS PROTEINS BALL STATE UNIVERSITY (US) 2000-02-29 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 (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-12331032-B2 Quinone reductase 2 inhibitor compounds and uses thereof NQO1, SQOR, NQO2 MAPT 3791/4885KMT2A 939/4885ALDH1A1 106/4885
US-20040248922-A1 LAVENDAMYCIN ANALOGS, QUINOLINE-5,8-DIONES AND METHODS OF USING THEM LSS, CYP51A1, COX5A MAPT 4560/4885KMT2A 1940/4885ALDH1A1 1342/4885
US-11351275-B2 Metal complexes with bisphophonate or pyrophosphate useful as imaging agents PPIP5K2, MPI, PHPT1 MAPT 861/4885KMT2A 3850/4885ALDH1A1 4853/4885

“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.