SCHEMBL456822

SCHEMBL456822

C[C@H](Nc1cc2ccccc2o1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.62
LMNA P02545 3/20 0.50
THRB P10828 1/20 0.50
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MAOB P27338 4/20 0.48
MAOA P21397 2/20 0.48
POLB P06746 1/20 0.47
FLT3 P36888 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
TP53 P04637 1/20 0.45
PKM P14618 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
HSD17B10 Q99714 3/20 0.45
USP2 O75604 1/20 0.45
TSHR P16473 2/20 0.45

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
SCHEMBL456821 1.00 ALDH1A1 (0.62) ALDH1A1LMNATHRBNPC1RAB9A
Hydrochloric Acid SCHEMBL1116447 0.98 ALDH1A1 (0.61) ALDH1A1LMNATHRBNPC1RAB9A
SCHEMBL8764646 0.79 CYP2D6 (0.51) ALDH1A1LMNATHRBNPC1RAB9A
SCHEMBL28275043 0.77 ALDH1A1 (1.00) ALDH1A1LMNATHRBNPC1RAB9A
SCHEMBL28275041 0.77 ALDH1A1 (1.00) ALDH1A1LMNATHRBNPC1RAB9A
SCHEMBL7442470 0.77 ALDH1A1 (0.61) ALDH1A1LMNATHRBNPC1RAB9A
SCHEMBL10823736 0.76 NPC1 (0.54) ALDH1A1LMNATHRBNPC1RAB9A
SCHEMBL4996449 0.76 ALDH1A1 (0.57) ALDH1A1LMNATHRBNPC1RAB9A
SCHEMBL18223966 0.75 ALDH1A1 (0.56) ALDH1A1LMNATHRB
SCHEMBL13652067 0.75 SMN1; SMN2 (0.64) ALDH1A1LMNANPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250242053-A1 RECOMBINANT THERAPEUTIC FMR1 CONSTRUCTS AND METHODS OF TREATING FRAGILE X SYNDROME AND RELATED DISORDERS THE UNIVERSITY COURT OF THE UNIVERSITY OF EDINBURGH (GB) 2025-07-31 US disclosed
EP-4584289-A2 THERAPEUTIC MOLECULES UEA Enterprises Limited (GB) 2025-07-16 EP disclosed
US-20250136651-A1 RECOMBINANT OPTIMIZED MECP2 CASSETTES AND METHODS FOR TREATING RETT SYNDROME AND RELATED DISORDERS THE UNIVERSITY COURT OF THE UNIVERSITY OF EDINBURGH (GB) 2025-05-01 US disclosed
EP-4514980-A1 RECOMBINANT THERAPEUTIC FMR1 CONSTRUCTS AND METHODS OF TREATING FRAGILE X SYNDROME AND RELATED DISORDERS The University Court Of The University of Edinburgh (GB) 2025-03-05 EP disclosed
WO-2023114816-A9 RECOMBINANT OPTIMIZED GALC CONSTRUCTS AND METHODS FOR TREATING GALC-ASSOCIATED DISORDERS NEUROGENE INC. (US) 2025-01-16 WO disclosed
CN-119301258-A Recombinant therapeutic FMR1 constructs and methods of treating fragile X syndrome and related disorders 爱丁堡大学董事会 2025-01-10 CN disclosed
EP-4473121-A1 RECOMBINANT OPTIMIZED MECP2 CASSETTES AND METHODS FOR TREATING RETT SYNDROME AND RELATED DISORDERS The University Court Of The University of Edinburgh (GB) 2024-12-11 EP disclosed
US-20240384267-A1 COMPOSITIONS AND METHODS FOR MULTIPLEX DECODING OF QUADRUPLET CODONS THE BROAD INSTITUTE, INC. 2024-11-21 US disclosed
CN-118696126-A Recombinant optimized MECP2 cassettes and methods for treating Rate syndrome and related disorders 爱丁堡大学董事会 2024-09-24 CN disclosed
WO-2024052694-A2 THERAPEUTIC MOLECULES UEA ENTERPRISES LIMITED (GB) 2024-03-14 WO disclosed
EP-2018437-A2 NON-NATURAL AMINO ACID SUBSTITUTED POLYPEPTIDES Allozyne, Inc. (US) 2009-01-28 EP disclosed
EP-1999259-A2 SITE-SPECIFIC INCORPORATION OF AMINO ACIDS INTO MOLECULES California Institute of Technology (US) 2008-12-10 EP disclosed
US-20080214439-A1 AMINO ACID SUBSTITUTED MOLECULES ALLOZYNE, INC. (US) 2008-09-04 US disclosed
US-20080200641-A1 AMINO ACID SUBSTITUTED MOLECULES ALLOZYNE, INC. (US) 2008-08-21 US disclosed
US-20080125347-A1 AMINO ACID SUBSTITUTED MOLECULES ALLOZYNE, INC. (US) 2008-05-29 US disclosed
US-20080096819-A1 Amino acid substituted molecules ALLOZYNE, INC. (US) 2008-04-24 US disclosed
US-20080044854-A1 SITE-SPECIFIC INCORPORATION OF AMINO ACIDS INTO MOLECULES CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2008-02-21 US disclosed
WO-2007149852-A2 MODIFIED FACTOR VIII AND FACTOR IX GENES AND VECTORS FOR GENE THERAPY ASKLEPIOS BIOPHARMACEUTICAL, INC. (US) 2007-12-27 WO disclosed
WO-2007130453-A2 NON-NATURAL AMINO ACID SUBSTITUTED POLYPEPTIDES ALLOZYNE, INC. (US) 2007-11-15 WO disclosed
WO-2007103307-A2 SITE-SPECIFIC INCORPORATION OF AMINO ACIDS INTO MOLECULES CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2007-09-13 WO 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-20080096819-A1 Amino acid substituted molecules BCAT2, DNPEP, PTMS ALDH1A1 2926/4885LMNA 3746/4885THRB 4351/4885
US-20080214439-A1 AMINO ACID SUBSTITUTED MOLECULES BCAT2, DNPEP, PTMS ALDH1A1 2926/4885LMNA 3746/4885THRB 4351/4885
US-20080200641-A1 AMINO ACID SUBSTITUTED MOLECULES BCAT2, DNPEP, PTMS ALDH1A1 2926/4885LMNA 3746/4885THRB 4351/4885
US-20080044854-A1 SITE-SPECIFIC INCORPORATION OF AMINO ACIDS INTO MOLECULES AARS1, TRMT1, NSUN3 ALDH1A1 4016/4885LMNA 3850/4885THRB 2057/4885
US-20080125347-A1 AMINO ACID SUBSTITUTED MOLECULES BCAT2, DNPEP, PTMS ALDH1A1 2926/4885LMNA 3746/4885THRB 4351/4885

“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.