SCHEMBL19873897

SCHEMBL19873897

CC(=O)OCn1c(=O)c(Br)cn(C(c2ccccc2)c2ccccc2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.34
▸ ELANE P08246 1/20 0.34
▸ PABPC1 P11940 1/20 0.34
▸ PLA2G4A P47712 4/20 0.33
▸ LMNA P02545 2/20 0.33
▸ LTB4R Q15722 1/20 0.33
▸ CCNB2 O95067 1/20 0.33
▸ CDK1 P06493 1/20 0.33
▸ CCNB1 P14635 1/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ CCNB3 Q8WWL7 1/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ MMP8 P22894 1/20 0.32
▸ MAPT P10636 1/20 0.31

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
SCHEMBL17870725 0.81 GAA (0.47) GAAKMT2A
SCHEMBL19873831 0.79 GAA (0.43) GAAALDH1A1PABPC1KMT2AMAPT
SCHEMBL19873713 0.78 GAA (0.47) GAAALDH1A1LMNA
SCHEMBL19873886 0.77 GNRHR (0.45) —
SCHEMBL30178655 0.77 GNRHR (0.45) —
SCHEMBL19873744 0.67 L3MBTL1 (0.35) ALDH1A1LMNA
SCHEMBL19873889 0.64 ALDH1A1 (0.37) ALDH1A1ELANELMNACCNB2CDK1
SCHEMBL19873733 0.63 ALDH1A1 (0.41) GAAALDH1A1KMT2AMAPT
SCHEMBL19873955 0.63 ALDH1A1 (0.35) ALDH1A1KMT2AMAPT
SCHEMBL28771275 0.62 ALDH1A1 (0.40) GAAALDH1A1PLA2G4ALMNAKMT2A

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
EP-3708566-B1 NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2023-02-08 — — EP disclosed
US-10246422-B2 Heterocyclic compounds and use thereof in medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT (FR) 2019-04-02 — — US disclosed
US-20180050992-A1 NOVEL HETEROCYCLIC COMPOUNDS AND USE THEREOF IN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2018-02-22 — — US 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 (2 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-20180050992-A1 NOVEL HETEROCYCLIC COMPOUNDS AND USE THEREOF IN MEDICINE AND IN COSMETICS MC1R, CALCRL, BDKRB2 GAA 1335/4885ALDH1A1 467/4885ELANE 717/4885
US-10246422-B2 Heterocyclic compounds and use thereof in medicine and in cosmetics MC1R, BDKRB2, CCKBR GAA 1096/4885ALDH1A1 554/4885ELANE 702/4885

“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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