SCHEMBL26125403

SCHEMBL26125403

COc1nn(C)cc1Nc1nn(C)c2cc(C(C)(C)O)ccc12

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 3/20 0.41
▸ KDR P35968 7/20 0.36
▸ GRM4 Q14833 2/20 0.35
▸ CYP11B1 P15538 1/20 0.34
▸ CYP11B2 P19099 1/20 0.34
▸ TGFBR1 P36897 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ P2RX7 Q99572 1/20 0.32
▸ MAP3K5 Q99683 1/20 0.32
▸ KCNA5 P22460 1/20 0.32
▸ RORC P51449 1/20 0.32

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
SCHEMBL30555523 1.00 KDM4C (0.41) KDM4CKDRGRM4CYP11B1CYP11B2
SCHEMBL23248496 0.91 KDM4C (0.39) KDM4CKDRGRM4CYP11B1CYP11B2
SCHEMBL30555510 0.91 KDM4C (0.39) KDM4CKDRGRM4CYP11B1CYP11B2
SCHEMBL30555530 0.88 GRM4 (0.38) KDM4CKDRGRM4MAP3K5
SCHEMBL26120831 0.88 GRM4 (0.38) KDM4CKDRGRM4MAP3K5
SCHEMBL30555427 0.87 KDM4C (0.39) KDM4CKDRP2RX7MAP3K5
SCHEMBL26120408 0.87 KDM4C (0.39) KDM4CKDRP2RX7MAP3K5
SCHEMBL30555465 0.87 P2RX7 (0.34) KDM4CCYP11B1CYP11B2TGFBR1LRRK2
SCHEMBL30555460 0.87 KDM4C (0.33) KDM4CCYP11B1CYP11B2TGFBR1LRRK2
SCHEMBL26122403 0.87 P2RX7 (0.34) KDM4CCYP11B1CYP11B2TGFBR1LRRK2

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
US-12358879-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-07-15 — — US disclosed
EP-4046688-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2025-04-09 — — EP disclosed
US-20230322683-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-12 — — US disclosed
US-20230322683-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-12 — — US disclosed
US-20230322683-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-12 — — US disclosed
EP-4046688-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2022-08-24 — — EP 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-20230322683-A1 HETEROCYCLIC COMPOUND PARK7, SMN1; SMN2, SNCA KDM4C 1231/4885KDR 4879/4885GRM4 1924/4885
US-12358879-B2 Heterocyclic compound PARK7, SMN1; SMN2, SNCA KDM4C 1231/4885KDR 4879/4885GRM4 1924/4885

“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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