SCHEMBL503650

SCHEMBL503650

C[C@H](Nn1cccn1)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
ELANE P08246 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
ADAMTS4 O75173 1/20 0.33
EGLN1 Q9GZT9 2/20 0.32
LMNA P02545 2/20 0.32
HTT P42858 1/20 0.32
PTGS2 P35354 1/20 0.32
MEN1 O00255 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL22660988 1.00 ALDH1A1 (0.36) ALDH1A1KEAP1NFE2L2HDAC4HDAC7
SCHEMBL5828254 0.74 FOLH1 (0.34) KDM4C
SCHEMBL6395056 0.74 FOLH1 (0.34) KDM4C
SCHEMBL5828102 0.72 ALDH1A1 (0.36) ALDH1A1HDAC4HDAC7HDAC8HDAC6
SCHEMBL10444406 0.71 ALDH1A1 (0.34) ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL10444407 0.71 ALDH1A1 (0.34) ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL15799718 0.70 LMNA (0.38) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL21925557 0.70 MME (0.47) ADAMTS4POLB
SCHEMBL5515039 0.70 HDAC4 (0.34) HDAC4HDAC7HDAC8HDAC6HDAC9
SCHEMBL8545489 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115015460-B Method for identifying cordyceps sinensis producing area by using wide-range targeted metabonomics technology 中国检验检疫科学研究院 2024-05-03 CN claimed
CN-115015460-A Method for identifying producing area of cordyceps sinensis by using extensive targeted metabonomics technology 中国检验检疫科学研究院 2022-09-06 CN claimed
US-20260001924-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME NEW YORK UNIVERSITY (US) 2026-01-01 US disclosed
US-12371461-B2 Nemo coiled coil mimics and methods of using same NEW YORK UNIVERSITY (US) 2025-07-29 US disclosed
EP-3303367-B1 STABILIZED MINIMAL COILED-COIL MIMETICS UNIV NEW YORK (US) 2025-06-18 EP disclosed
WO-2024130161-A2 NOVEL CAMPTOTHECIN DERIVATIVES AND CONJUGATES THEREOF BIONECURE THERAPEUTICS INC (US) 2024-06-20 WO disclosed
US-20240190930-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME UNIV NEW YORK (US) 2024-06-13 US disclosed
CN-115015460-B Method for identifying cordyceps sinensis producing area by using wide-range targeted metabonomics technology 中国检验检疫科学研究院 2024-05-03 CN disclosed
US-20240124539-A1 CROSSLINKED HELIX DIMER MIMICS OF SOS AND METHODS OF USING SAME NEW YORK UNIVERSITY 2024-04-18 US disclosed
US-11891422-B2 NEMO coiled coil mimics and methods of using same NEW YORK UNIVERSITY (US) 2024-02-06 US disclosed
US-20240034753-A1 THERAPEUTIC PEPTIDES COHBAR, INC. 2024-02-01 US disclosed
WO-2018064098-A1 THERAPEUTIC MOTS-C RELATED PEPTIDES COHBAR, INC. (US) 2018-04-05 WO disclosed
US-9540620-B2 Methods and compositions for modulating G-alpha-Q signaling THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2017-01-10 US disclosed
US-20160153015-A1 SYNTHESIS METHOD FOR L-HETEROCYCLIC AMINO ACID AND PHARMACEUTICAL COMPOSITION HAVING THEREOF JILIN ASYMCHEM LABORATORIES CO., LTD (CN) 2016-06-02 US disclosed
US-20160108049-A1 Novel Phthalazinone-Pyrrolopyrimidinecarboxamide Derivatives ASTRAZENECA AB (SE) 2016-04-21 US disclosed
US-20150218538-A1 Methods and Compositions for Modulating G-Alpha-Q Signaling NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-08-06 US disclosed
US-20140112945-A1 NOVEL PHTHALAZINONE-PYRROLOPYRIMIDINECARBOXAMIDE DERIVATIVES TAKEDA GMBH (DE) 2014-04-24 US disclosed
US-8445678-B2 2-quinoxalinol salen compounds and uses thereof AUBURN UNIVERSITY (US) 2013-05-21 US disclosed
US-20120028362-A1 2-QUINOXALINOL SALEN COMPOUNDS AND USES THEREOF AUBURN UNIVERSITY (US) 2012-02-02 US disclosed
US-20090286968-A1 2-Quinoxalinol Salen Compounds and Uses Thereof AUBURN UNIVERSITY (US) 2009-11-19 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 (10 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-20160153015-A1 SYNTHESIS METHOD FOR L-HETEROCYCLIC AMINO ACID AND PHARMACEUTICAL COMPOSITION HAVING THEREOF IDH1, IDH3A, IDH3B ALDH1A1 198/4885KEAP1 1453/4885NFE2L2 2617/4885
US-12371461-B2 Nemo coiled coil mimics and methods of using same COIL, CALCOCO2, NCAPH ALDH1A1 3890/4885KEAP1 1325/4885NFE2L2 553/4885
US-20090286968-A1 2-Quinoxalinol Salen Compounds and Uses Thereof NQO1, NQO2, SQOR ALDH1A1 1265/4885KEAP1 90/4885NFE2L2 111/4885
US-20120028362-A1 2-QUINOXALINOL SALEN COMPOUNDS AND USES THEREOF NQO1, NQO2, SQOR ALDH1A1 1265/4885KEAP1 90/4885NFE2L2 111/4885
US-20240124539-A1 CROSSLINKED HELIX DIMER MIMICS OF SOS AND METHODS OF USING SAME SOS2, SOS1, F2 ALDH1A1 3199/4885KEAP1 542/4885NFE2L2 184/4885
US-20260001924-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME DDX21, PHAX, RBX1 ALDH1A1 4748/4885KEAP1 2427/4885NFE2L2 661/4885
US-11891422-B2 NEMO coiled coil mimics and methods of using same COIL, CALCOCO2, NCAPH ALDH1A1 3890/4885KEAP1 1325/4885NFE2L2 553/4885
US-20160108049-A1 Novel Phthalazinone-Pyrrolopyrimidinecarboxamide Derivatives PDE4A, PDE4B, PDE5A ALDH1A1 487/4885KEAP1 2969/4885NFE2L2 3459/4885
US-20240190930-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME COIL, CALCOCO2, NCAPH ALDH1A1 3702/4885KEAP1 1341/4885NFE2L2 594/4885
US-20140112945-A1 NOVEL PHTHALAZINONE-PYRROLOPYRIMIDINECARBOXAMIDE DERIVATIVES PDE4A, PDE4B, PDE5A ALDH1A1 625/4885KEAP1 3096/4885NFE2L2 3606/4885

“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.