SCHEMBL23930447

SCHEMBL23930447

COC(=O)COCCOC1CCCCO1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
EPHX2 P34913 2/20 0.35
KDM4C Q9H3R0 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.32
SLC6A3 Q01959 2/20 0.32
PDE8B O95263 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CREBBP Q92793 2/20 0.31
HRH1 P35367 1/20 0.31
EP300 Q09472 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
SCHEMBL23092850 0.86 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL9724933 0.86 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL20548080 0.85 KMT2A (0.41) MEN1KMT2AHPGDNPC1RAB9A
SCHEMBL12221438 0.83 MEN1 (0.46) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL1933912 0.83 MEN1 (0.49) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL21657581 0.82 MEN1 (0.48) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL31255467 0.81 MEN1 (0.42) MEN1KMT2ANPC1RAB9AKDM4C
SCHEMBL5211517 0.81 KMT2A (0.48) MEN1KMT2AALDH1A1HPGDNPC1
SCHEMBL1516089 0.81 KMT2A (0.50) MEN1KMT2ANPC1RAB9AEPHX2
SCHEMBL7939089 0.80 MEN1 (0.50) MEN1KMT2AALDH1A1HPGDNPC1

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
EP-4139294-B1 ISOQUINILINE NRF2 AGONISTS C4X DISCOVERY LTD (GB) 2025-04-09 EP disclosed
US-20230167084-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS NRF2 ACTIVATORS C4X DISCOVERY LIMITED (GB) 2023-06-01 US disclosed
EP-4139294-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS NRF2 ACTIVATORS C4x Discovery Limited (GB) 2023-03-01 EP disclosed
CN-115667243-A Tetrahydroisoquinoline compounds as NRF2 activators 希四克斯探索有限公司 2023-01-31 CN disclosed
WO-2021214470-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS NRF2 ACTIVATORS C4X DISCOVERY LIMITED (GB) 2021-10-28 WO 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-20230167084-A1 TETRAHYDROISOQUINOLINE COMPOUNDS AS NRF2 ACTIVATORS NFE2L2, KEAP1, NQO1 MEN1 4307/4885KMT2A 1158/4885ALDH1A1 773/4885

“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.