SCHEMBL29970758

SCHEMBL29970758

CCCCOC(=O)NCc1ncc(Sc2cc(OC)cc(-c3ccccc3)c2)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 3/20 0.43
LOXL3 P58215 1/20 0.43
ALDH1A1 P00352 3/20 0.40
TSHR P16473 2/20 0.40
GAA P10253 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 1/20 0.36
DDX3X O00571 1/20 0.35
HPGD P15428 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP1A2 P05177 1/20 0.35
NFKB1 P19838 1/20 0.35
CYP2C19 P33261 1/20 0.35
STAT1 P42224 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
MAPK14 Q16539 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL29970697 0.87 LOXL2 (0.42) LOXL2LOXL3ALDH1A1TSHRGAA
SCHEMBL19259729 0.86 LOXL2 (0.49) LOXL2LOXL3ALDH1A1KDM4EHPGD
SCHEMBL29970081 0.86 LOXL2 (0.43) LOXL2LOXL3ALDH1A1TSHRGAA
SCHEMBL19260160 0.86 LOXL2 (0.41) LOXL2LOXL3ALDH1A1TSHRGAA
SCHEMBL19274724 0.85 LOXL2 (0.45) LOXL2LOXL3HSD17B10MAPK14GLS
SCHEMBL19274640 0.81 LOXL2 (0.40) LOXL2LOXL3ALDH1A1TSHRGAA
SCHEMBL30699957 0.81 LOXL2 (0.40) LOXL2LOXL3ALDH1A1TSHRGAA
SCHEMBL20983626 0.77 LOXL2 (0.44) LOXL2LOXL3GLS
SCHEMBL21016737 0.76 LOXL2 (0.66) LOXL2LOXL3
SCHEMBL29970950 0.76 SMN1; SMN2 (0.39) LOXL2ALDH1A1TSHRGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220372028-A1 Methylamine Derivatives as Lysysl Oxidase Inhibitors for the Treatment of Cancer THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2022-11-24 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 (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-20220372028-A1 Methylamine Derivatives as Lysysl Oxidase Inhibitors for the Treatment of Cancer LOXL1, LOXL3, LOXL2 LOXL2 3/4885LOXL3 2/4885ALDH1A1 2293/4885

“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.