SCHEMBL30555465

SCHEMBL30555465

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

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 5/20 0.34
▸ PTK6 Q13882 1/20 0.34
▸ LRRK2 Q5S007 1/20 0.34
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ RORC P51449 7/20 0.32
▸ TGFBR1 P36897 1/20 0.32
▸ KDM4C Q9H3R0 1/20 0.32
▸ EGFR P00533 1/20 0.32
▸ ERBB3 P21860 1/20 0.32
▸ JAK2 O60674 1/20 0.31
▸ JAK1 P23458 1/20 0.31
▸ TYK2 P29597 1/20 0.31
▸ JAK3 P52333 1/20 0.31
▸ NTRK1 P04629 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
SCHEMBL26122403 1.00 P2RX7 (0.34) P2RX7PTK6LRRK2CYP11B1CYP11B2
SCHEMBL26124399 0.92 CYP11B1 (0.34) P2RX7PTK6LRRK2CYP11B1CYP11B2
SCHEMBL30555513 0.92 CYP11B1 (0.34) P2RX7PTK6LRRK2CYP11B1CYP11B2
SCHEMBL30555523 0.87 KDM4C (0.41) P2RX7LRRK2CYP11B1CYP11B2RORC
SCHEMBL26125403 0.87 KDM4C (0.41) P2RX7LRRK2CYP11B1CYP11B2RORC
SCHEMBL23248470 0.87 P2RX7 (0.33) P2RX7PTK6LRRK2CYP11B1CYP11B2
SCHEMBL30555483 0.85 SYK (0.36) P2RX7
SCHEMBL26123684 0.85 SYK (0.36) P2RX7
SCHEMBL30555460 0.84 KDM4C (0.33) P2RX7LRRK2CYP11B1CYP11B2RORC
SCHEMBL26122296 0.84 KDM4C (0.33) P2RX7LRRK2CYP11B1CYP11B2RORC

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 3 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

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 P2RX7 3873/4885PTK6 4480/4885LRRK2 18/4885
US-12358879-B2 Heterocyclic compound PARK7, SMN1; SMN2, SNCA P2RX7 3873/4885PTK6 4480/4885LRRK2 18/4885

“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.

Send feedback