SCHEMBL22071191

SCHEMBL22071191

O=C(CCc1ccc(-c2ccccc2)cc1)Nc1cc(Cl)ccc1C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 14/20 0.77
ALOX15 P16050 1/20 0.63
MAPK1 P28482 1/20 0.63
GRIK1 P39086 1/20 0.62
ACLY P53396 1/20 0.61
KDM4E B2RXH2 2/20 0.60
ALDH1A1 P00352 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58

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
SCHEMBL1307810 0.92 ALOX15 (0.73) HCAR2ALOX15MAPK1GRIK1KDM4E
SCHEMBL22022932 0.91 HCAR2 (0.71) HCAR2ALOX15MAPK1GRIK1KDM4E
SCHEMBL22022862 0.91 HCAR2 (0.65) HCAR2ALOX15MAPK1GRIK1ACLY
SCHEMBL27520024 0.91 KDM4E (0.67) HCAR2ALOX15MAPK1GRIK1KDM4E
SCHEMBL22022930 0.90 KDM4E (0.64) HCAR2ALOX15MAPK1GRIK1KDM4E
SCHEMBL22022898 0.90 HCAR2 (0.70) HCAR2ALOX15MAPK1GRIK1ACLY
SCHEMBL22022931 0.89 HCAR2 (0.62) HCAR2ALOX15MAPK1GRIK1ACLY
SCHEMBL22022910 0.88 KDM4E (0.72) HCAR2ALOX15MAPK1KDM4EALDH1A1
SCHEMBL22022923 0.88 HCAR2 (0.67) HCAR2ALOX15MAPK1GRIK1ACLY
SCHEMBL22022902 0.87 HCAR2 (0.60) HCAR2ALOX15MAPK1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220054438-A1 KCHIP2 MODULATOR COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CARDIOVASCULAR DISEASES CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (CSIC) (ES) 2022-02-24 US disclosed
EP-3662908-A1 MODULATING COMPOUNDS OF KCHIP2 AND ITS USE FOR THE TREATMENT OF CARDIOVASCULAR PATHOLOGIES Consejo Superior de Investigaciones Cientificas (CSIC) (ES) 2020-06-10 EP 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 (1 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-20220054438-A1 KCHIP2 MODULATOR COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CARDIOVASCULAR DISEASES KCNK2, KCNT2, KCNT1 HCAR2 165/4885ALOX15 3777/4885MAPK1 2984/4885

“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.