SCHEMBL22022902

SCHEMBL22022902

CC(C)(C)c1ccc(-c2ccc(CCC(=O)Nc3cc(Cl)ccc3C(=O)O)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 13/20 0.60
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 2/20 0.57
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
ALOX15 P16050 1/20 0.51
MAPK1 P28482 1/20 0.51
SERPINE1 P05121 1/20 0.50
NR1H4 Q96RI1 1/20 0.48

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
SCHEMBL22022863 0.91 HCAR2 (0.60) HCAR2KDM4EALDH1A1MEN1KMT2A
SCHEMBL22022867 0.89 MEN1 (0.66) HCAR2KDM4EALDH1A1MEN1KMT2A
SCHEMBL22022930 0.87 KDM4E (0.64) HCAR2KDM4EALDH1A1MEN1KMT2A
SCHEMBL22071191 0.87 HCAR2 (0.77) HCAR2KDM4EALDH1A1MEN1KMT2A
SCHEMBL22022932 0.86 HCAR2 (0.71) HCAR2KDM4EALDH1A1MEN1KMT2A
SCHEMBL22022862 0.86 HCAR2 (0.65) HCAR2KDM4EALDH1A1MEN1KMT2A
SCHEMBL27520024 0.86 KDM4E (0.67) HCAR2KDM4EALDH1A1MEN1KMT2A
SCHEMBL22022910 0.85 KDM4E (0.72) HCAR2KDM4EALDH1A1MEN1KMT2A
SCHEMBL27573121 0.85 GRIK1 (0.63) HCAR2KDM4EALDH1A1MEN1KMT2A
SCHEMBL1307810 0.82 ALOX15 (0.73) HCAR2KDM4EALDH1A1MEN1KMT2A

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 3 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
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 165/4885KDM4E 967/4885ALDH1A1 3537/4885

“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.