SCHEMBL22149604

SCHEMBL22149604

COc1cc2cc(OC)c(C(=O)O)cc2cc1C(=O)O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.78
ALDH1A1 P00352 3/20 0.78
HPGD P15428 2/20 0.78
HSD17B10 Q99714 2/20 0.62
LCK P06239 1/20 0.59
FYN P06241 1/20 0.59
NPSR1 Q6W5P4 1/20 0.49
CA12 O43570 3/20 0.47
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
CA4 P22748 3/20 0.47
CA6 P23280 3/20 0.47
CA7 P43166 3/20 0.47
CA9 Q16790 3/20 0.47
CA14 Q9ULX7 3/20 0.47
CA3 P07451 2/20 0.47
CA5A P35218 2/20 0.47
CA5B Q9Y2D0 2/20 0.47
PKM P14618 1/20 0.47
MAPT P10636 1/20 0.46

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
SCHEMBL2830233 0.88 LCK (0.72) KDM4EALDH1A1HPGDHSD17B10LCK
SCHEMBL617928 0.88 ALDH1A1 (1.00) KDM4EALDH1A1HPGDHSD17B10CA12
SCHEMBL978583 0.87 KDM4E (0.72) KDM4EALDH1A1HPGDHSD17B10NPSR1
Hydrochloric Acid SCHEMBL7287472 0.86 ALDH1A1 (0.96) KDM4EALDH1A1HPGDHSD17B10CA12
SCHEMBL9561825 0.86 ALDH1A1 (0.96) KDM4EALDH1A1HPGDHSD17B10CA12
Hydrochloric Acid SCHEMBL8902783 0.86 LCK (0.69) KDM4EALDH1A1HPGDHSD17B10LCK
SCHEMBL12444067 0.86 ALDH1A1 (0.64) KDM4EALDH1A1HPGDHSD17B10LCK
SCHEMBL5695675 0.86 ALDH1A1 (0.70) KDM4EALDH1A1HPGDHSD17B10CA12
SCHEMBL358180 0.86 KDM4E (0.70) KDM4EALDH1A1HPGDHSD17B10LCK
SCHEMBL8204839 0.86 ALDH1A1 (0.70) KDM4EALDH1A1HPGDHSD17B10LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912646-B2 Transmembrane pores formed by aromatic oligoamide foldamers and uses of same THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2024-02-27 US disclosed
US-20220380301-A9 TRANSMEMBRANE PORES FORMED BY AROMATIC OLIGOAMIDE FOLDAMERS AND USES OF SAME THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK 2022-12-01 US disclosed
US-20210355078-A1 TRANSMEMBRANE PORES FORMED BY AROMATIC OLIGOAMIDE FOLDAMERS AND USES OF SAME UNIV NEW YORK STATE RES FOUND (US) 2021-11-18 US disclosed
US-11072578-B2 Transmembrane pores formed by aromatic oligoamide foldamers and uses of same THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2021-07-27 US disclosed
US-20200199066-A1 TRANSMEMBRANE PORES FORMED BY AROMATIC OLIGOAMIDE FOLDAMERS AND USES OF SAME THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK 2020-06-25 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 (5 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-20210355078-A1 TRANSMEMBRANE PORES FORMED BY AROMATIC OLIGOAMIDE FOLDAMERS AND USES OF SAME AQP1, STOM, SLC22A8 KDM4E 4558/4885ALDH1A1 4354/4885HPGD 3751/4885
US-11912646-B2 Transmembrane pores formed by aromatic oligoamide foldamers and uses of same AQP1, STOM, SLC22A8 KDM4E 4558/4885ALDH1A1 4354/4885HPGD 3751/4885
US-11072578-B2 Transmembrane pores formed by aromatic oligoamide foldamers and uses of same AQP1, STOM, SLC22A8 KDM4E 4558/4885ALDH1A1 4354/4885HPGD 3751/4885
US-20200199066-A1 TRANSMEMBRANE PORES FORMED BY AROMATIC OLIGOAMIDE FOLDAMERS AND USES OF SAME AQP1, STOM, SLC22A8 KDM4E 4558/4885ALDH1A1 4354/4885HPGD 3751/4885
US-20220380301-A9 TRANSMEMBRANE PORES FORMED BY AROMATIC OLIGOAMIDE FOLDAMERS AND USES OF SAME AQP1, STOM, SLC22A8 KDM4E 4558/4885ALDH1A1 4354/4885HPGD 3751/4885

“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.