SCHEMBL30775110

SCHEMBL30775110

O=C(O)c1cc(F)ccc1-n1nccn1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 19/20 0.49
HCRTR2 O43614 17/20 0.49
KEAP1 Q14145 1/20 0.49
CYP1A2 P05177 1/20 0.43

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
SCHEMBL1586913 1.00 HCRTR1 (0.49) HCRTR1HCRTR2KEAP1CYP1A2
SCHEMBL27870879 0.88 HCRTR1 (0.50) HCRTR1HCRTR2CYP1A2
SCHEMBL31707742 0.86 HCRTR1 (0.51) HCRTR1HCRTR2KEAP1CYP1A2
SCHEMBL1586788 0.86 HCRTR1 (0.51) HCRTR1HCRTR2KEAP1CYP1A2
SCHEMBL27029847 0.85 HCRTR1 (0.48) HCRTR1HCRTR2
SCHEMBL16666179 0.85 HCRTR1 (0.48) HCRTR1HCRTR2CYP1A2
SCHEMBL29931070 0.85 HCRTR1 (0.48) HCRTR1HCRTR2
SCHEMBL12179368 0.85 HCRTR1 (0.51) HCRTR1HCRTR2CYP1A2
SCHEMBL19206997 0.82 KEAP1 (0.45) HCRTR1HCRTR2KEAP1
SCHEMBL18594640 0.81 HCRTR1 (0.48) HCRTR1HCRTR2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122010922-A Benzoxazole compounds, pharmaceutical compositions containing same and uses thereof 株洲千金药业股份有限公司 2026-05-12 CN disclosed
EP-4688154-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - Portela & Ca., S.A. (PT) 2026-02-11 EP disclosed
EP-4688155-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS Bial-Portela & CA, S.A. (PT) 2026-02-11 EP disclosed
WO-2025023851-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - PORTELA & CA., S.A. (PT) 2025-01-30 WO disclosed
WO-2025023852-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - PORTELA & CA., S.A. (PT) 2025-01-30 WO disclosed
CN-113164458-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-13 CN disclosed
CN-111315734-B Substituted 2-azabicyclo [3.1.1] heptane and 2-azabicyclo [3.2.1] octane derivatives as orexin receptor antagonists 克罗诺斯治疗有限公司 2024-03-08 CN disclosed