SCHEMBL22022893

SCHEMBL22022893

CCCCc1ccc(-c2ccc(CC(=O)Nc3cc(Cl)ccc3C(=O)O)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.65
▸ KMT2A Q03164 3/20 0.65
▸ KDM4E B2RXH2 3/20 0.65
▸ ALDH1A1 P00352 3/20 0.65
▸ KCNK2 O95069 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ ACLY P53396 1/20 0.57
▸ AKR1C2 P52895 1/20 0.53
▸ AKR1C1 Q04828 1/20 0.53
▸ KDM5A P29375 1/20 0.50
▸ KDM4C Q9H3R0 1/20 0.50
▸ KDM5B Q9UGL1 1/20 0.50
▸ HCAR2 Q8TDS4 1/20 0.50
▸ EIF4A1 P60842 2/20 0.49
▸ RARB P10826 3/20 0.49
▸ CTRC Q99895 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ RARA P10276 1/20 0.49
▸ RARG P13631 1/20 0.49
▸ PLK1 P53350 3/20 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
SCHEMBL22022913 0.92 ACLY (0.59) MEN1KMT2AKDM4EALDH1A1KCNK2
SCHEMBL22022910 0.91 KDM4E (0.72) MEN1KMT2AKDM4EALDH1A1KCNK2
SCHEMBL22022916 0.88 MEN1 (0.70) MEN1KMT2AKDM4EALDH1A1KCNK2
SCHEMBL19511998 0.86 ACLY (0.56) MEN1KMT2AKDM4EALDH1A1KCNK2
SCHEMBL22022864 0.86 ACLY (0.75) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL22022933 0.84 MEN1 (0.68) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL22022868 0.84 KMT2A (0.68) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL22022904 0.84 HCAR2 (0.65) MEN1KMT2AKDM4EALDH1A1KCNK2
SCHEMBL1309256 0.84 MEN1 (0.78) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL22022867 0.83 MEN1 (0.66) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2

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 4 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
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 MEN1 4366/4885KMT2A 1216/4885KDM4E 967/4885

“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.

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