SCHEMBL26107963

SCHEMBL26107963

Cn1c(C2=CCC3(CCNCC3)CC2)c(-c2ncccn2)c2c(N)ncnc21

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 5/20 0.34
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ RET P07949 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ DYRK1A Q13627 1/20 0.31
▸ CCNT1 O60563 1/20 0.30
▸ CDK9 P50750 1/20 0.30

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
SCHEMBL30582547 0.88 LRRK2 (0.39) LRRK2RETDYRK1A
SCHEMBL31219432 0.88 RET (0.33) LRRK2RET
SCHEMBL26108241 0.88 LRRK2 (0.39) LRRK2RETDYRK1A
SCHEMBL26106829 0.87 SOS1 (0.31) —
SCHEMBL26106237 0.85 DYRK1A (0.33) DYRK1A
SCHEMBL30582602 0.85 DYRK1A (0.33) DYRK1A
SCHEMBL30582601 0.85 PIK3CD (0.40) LRRK2RETDYRK1ACCNT1CDK9
SCHEMBL26105782 0.85 PIK3CD (0.40) LRRK2RETDYRK1ACCNT1CDK9
SCHEMBL26134176 0.84 LRRK2 (0.32) LRRK2RETCCNT1CDK9
SCHEMBL26107050 0.84 LCK (0.40) RET

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
WO-2025067484-A1 CRYSTAL FORMS AND SALTS OF SPIROBICYCLIC COMPOUND ACERAND THERAPEUTICS (HONG KONG) LIMITED (CN) 2025-04-03 — — WO disclosed
EP-4499616-A1 SPIROBICYCLIC COMPOUNDS Acerand Therapeutics (Hong Kong) Limited (HK) 2025-02-05 — — EP disclosed
CN-119013260-A Spirobicyclic compounds 优领医药科技(香港)有限公司 2024-11-22 — — CN disclosed
WO-2024091370-A1 5,6-FUSED BICYCLIC HETEROAROMATIC COMPOUNDS ACERAND THERAPEUTICS (USA) LIMITED (US) 2024-05-02 — — WO disclosed
WO-2023192502-A1 SPIROBICYCLIC COMPOUNDS ACERAND THERAPEUTICS (USA) LIMITED (US) 2023-10-05 — — WO disclosed
Send feedback