SCHEMBL25365595

SCHEMBL25365595

COc1ccc(-c2nc3cnc(-c4ccc(N5C[C@H]6CN(CC(C)C)C[C@H]6C5)cc4)cc3n2C2CC2)cc1OC

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.39
▸ MAPT P10636 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ TLR9 Q9NR96 3/20 0.38
▸ TLR8 Q9NR97 3/20 0.38
▸ TLR7 Q9NYK1 2/20 0.38
▸ PRKDC P78527 1/20 0.36
▸ HPGD P15428 2/20 0.36
▸ CYP11B1 P15538 11/20 0.35
▸ CYP11B2 P19099 10/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MAP4K1 Q92918 1/20 0.33

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
SCHEMBL25363473 0.90 ALDH1A1 (0.38) ALDH1A1MAPTKDM4ETLR9TLR8
SCHEMBL25367831 0.89 TLR9 (0.38) ALDH1A1MAPTKDM4ETLR9TLR8
SCHEMBL25366895 0.87 TLR8 (0.39) ALDH1A1MAPTKDM4ETLR9TLR8
SCHEMBL25365766 0.84 GPR119 (0.46) CYP11B1CYP11B2
SCHEMBL25364307 0.81 PRKDC (0.37) ALDH1A1MAPTKDM4ETLR9TLR8
SCHEMBL25364198 0.80 TGFBR1 (0.37) ALDH1A1MAPTKDM4ETLR9TLR8
SCHEMBL30541588 0.76 MAPT (0.39) ALDH1A1MAPTKDM4ETLR9TLR8
SCHEMBL25364050 0.76 MAPT (0.39) ALDH1A1MAPTKDM4ETLR9TLR8
SCHEMBL25365515 0.73 CYP11B2 (0.45) ALDH1A1KDM4EHPGDCYP11B1CYP11B2
SCHEMBL30541622 0.73 CYP11B2 (0.45) ALDH1A1KDM4EHPGDCYP11B1CYP11B2

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-20250163054-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-22 — — US claimed
EP-4479407-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 Bristol-Myers Squibb Company (US) 2024-12-25 — — EP claimed
WO-2023159153-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-24 — — WO claimed
US-20250163054-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-22 — — US disclosed
EP-4479407-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 Bristol-Myers Squibb Company (US) 2024-12-25 — — EP disclosed
WO-2023159153-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-24 — — 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 (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-20250163054-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS INHIBITORS OF TLR9 TLR9, TLR3, TLR1 ALDH1A1 2903/4885MAPT 4878/4885KDM4E 1247/4885

“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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