SCHEMBL23534366

SCHEMBL23534366

CCOC(=O)c1cn2cc(C3CC3)ncc2n1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.53
POLB P06746 1/20 0.53
GAA P10253 2/20 0.48
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
CYP1A2 P05177 1/20 0.42
RAB9A P51151 5/20 0.42
NPC1 O15118 3/20 0.42
RXFP1 Q9HBX9 1/20 0.42
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.41
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GABRA2 P47869 2/20 0.39
GABRB2 P47870 2/20 0.39
GLA P06280 1/20 0.38
CSNK1D P48730 1/20 0.37

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
SCHEMBL21033145 0.92 KDM4E (0.48) KDM4EPOLBGAAALDH1A1HPGD
SCHEMBL21033146 0.90 KDM4E (0.46) KDM4EPOLBGAAALDH1A1HPGD
SCHEMBL21001605 0.85 HPGD (0.50) KDM4EPOLBGAAALDH1A1HPGD
SCHEMBL15176026 0.83 KDM4E (0.62) KDM4EPOLBGAAALDH1A1HPGD
SCHEMBL23571487 0.80 PTGS1 (0.43) KDM4EPOLBALDH1A1RXFP1KMT2A
SCHEMBL21355432 0.80 KDM4E (0.59) KDM4EPOLBGAAALDH1A1HPGD
SCHEMBL20384719 0.79 KDM4E (0.58) KDM4EPOLBGAAALDH1A1HPGD
SCHEMBL21033290 0.78 KDM4E (0.46) KDM4EPOLBGAAALDH1A1HPGD
SCHEMBL21014297 0.77 KDM4E (0.50) KDM4EPOLBGAAALDH1A1HPGD
SCHEMBL26093938 0.77 KDM4E (0.55) KDM4EPOLBGAAALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4076460-B1 1,4-DIHYDRO-2H-SPIRO[ISOQUINOLINE-3,4'-PIPERIDINE DERIVATIVES AS PRMT5 INHIBITORS FOR THE TREATMENT OF CANCER MERCK SHARP & DOHME LLC (US) 2026-01-21 EP disclosed
US-12441730-B2 PRMT5 inhibitors MERCK SHARP & DOHME LLC (US) 2025-10-14 US disclosed
CN-118434744-A Nitrogen-containing macrocyclic compound, and preparation method and medical application thereof 中国医药研究开发中心有限公司 2024-08-02 CN disclosed
US-20230114091-A1 PRMT5 INHIBITORS MERCK SHARP & DOHME LLC (US) 2023-04-13 US disclosed
EP-4076460-A1 PRMT5 INHIBITORS Merck Sharp & Dohme LLC (US) 2022-10-26 EP disclosed
WO-2021126729-A1 PRMT5 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2021-06-24 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 (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-20230114091-A1 PRMT5 INHIBITORS PRMT5, PRMT1, PRMT3 KDM4E 61/4885POLB 1640/4885GAA 3202/4885
US-12441730-B2 PRMT5 inhibitors PRMT5, PRMT1, PRMT3 KDM4E 61/4885POLB 1640/4885GAA 3202/4885

“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.