SCHEMBL21385358

SCHEMBL21385358

O=C(O)c1cc(/C=C/c2ccccc2)ccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 1.00
HNF4A P41235 2/20 1.00
PTPN6 P29350 2/20 0.89
PTPN2 P17706 1/20 0.89
PTGS2 P35354 1/20 0.72
LCK P06239 1/20 0.66
APP P05067 5/20 0.64
SLC7A11 Q9UPY5 1/20 0.56
DHODH Q02127 1/20 0.55
PIM1 P11309 1/20 0.55
DHFR P00374 1/20 0.55
MCL1 Q07820 1/20 0.55
ACMSD Q8TDX5 1/20 0.55
GUSB P08236 1/20 0.54
CSNK2A1 P68400 1/20 0.53

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
SCHEMBL673426 1.00 PTPN1 (1.00) PTPN1HNF4APTPN6PTPN2PTGS2
SCHEMBL30075246 1.00 PTPN1 (1.00) PTPN1HNF4APTPN6PTPN2PTGS2
SCHEMBL6266629 0.94 PTPN1 (1.00) PTPN1HNF4APTPN6PTPN2PTGS2
SCHEMBL1048686 0.94 PTPN1 (1.00) PTPN1HNF4APTPN6PTPN2PTGS2
SCHEMBL6266631 0.94 PTPN1 (1.00) PTPN1HNF4APTPN6PTPN2PTGS2
SCHEMBL29938670 0.94 PTPN1 (1.00) PTPN1HNF4APTPN6PTPN2PTGS2
SCHEMBL23143202 0.91 PTPN1 (0.84) PTPN1HNF4APTPN6PTPN2PTGS2
SCHEMBL30075263 0.91 PTPN1 (0.84) PTPN1HNF4APTPN6PTPN2PTGS2
SCHEMBL29759537 0.91 PTPN1 (0.84) PTPN1HNF4APTPN6PTPN2PTGS2
SCHEMBL8229587 0.89 PTPN1 (0.81) PTPN1HNF4APTPN6PTPN2PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11858889-B2 Compound for modulating DDAH and ADMA levels, as well as methods of using thereof to treat disease THE TRUSTEES OF INDIANA UNIVERSITY (US) 2024-01-02 US disclosed
US-11858889-B2 Compound for modulating DDAH and ADMA levels, as well as methods of using thereof to treat disease THE TRUSTEES OF INDIANA UNIVERSITY (US) 2024-01-02 US disclosed
EP-4021504-A1 THERAPY Vestlandets Innovasjonsselskap AS (NO) 2022-07-06 EP disclosed
US-20220144795-A1 COMPOUND FOR MODULATING DDAH AND ADMA LEVELS, AS WELL AS METHODS OF USING THEREOF TO TREAT DISEASE UNIV INDIANA TRUSTEES (US) 2022-05-12 US disclosed
WO-2021058979-A1 THERAPY VESTLANDETS INNOVASJONSSELSKAP AS (NO) 2021-04-01 WO disclosed
EP-3768836-A1 ALZHEIMER'S DISEASE ANIMAL MODEL AND USE THEREOF Tsinghua University (CN) 2021-01-27 EP disclosed
US-20210009498-A1 COMPOUND FOR MODULATING DDAH AND ADMA LEVELS, AS WELL AS METHODS OF USING THEREOF TO TREAT DISEASE THE TRUSTEES OF INDIANA UNIVERSITY 2021-01-14 US disclosed
WO-2019179445-A1 ALZHEIMER'S DISEASE ANIMAL MODEL AND USE THEREOF TSINGHUA UNIVERSITY (CN) 2019-09-26 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 (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-11858889-B2 Compound for modulating DDAH and ADMA levels, as well as methods of using thereof to treat disease ADM2, DDAH1, BHMT PTPN1 4322/4885HNF4A 1489/4885PTPN6 4240/4885
US-20220144795-A1 COMPOUND FOR MODULATING DDAH AND ADMA LEVELS, AS WELL AS METHODS OF USING THEREOF TO TREAT DISEASE ADM2, DDAH1, BHMT PTPN1 4322/4885HNF4A 1489/4885PTPN6 4240/4885
US-20210009498-A1 COMPOUND FOR MODULATING DDAH AND ADMA LEVELS, AS WELL AS METHODS OF USING THEREOF TO TREAT DISEASE ADM2, DDAH1, BHMT PTPN1 4322/4885HNF4A 1489/4885PTPN6 4240/4885

“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.