SCHEMBL31336769

SCHEMBL31336769

Cc1c(-c2cc(F)ccn2)c(C(=O)O)nn1C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JMJD6 Q6NYC1 1/20 0.39
KDM4E B2RXH2 3/20 0.38
POLB P06746 2/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
APOBEC3A P31941 1/20 0.38
KDM4C Q9H3R0 4/20 0.37
KDM5A P29375 2/20 0.37
KDM5B Q9UGL1 2/20 0.37
KDM4A O75164 1/20 0.37
GRM5 P41594 5/20 0.37
ASPH Q12797 1/20 0.36
KDM8 Q8N371 1/20 0.36
TTR P02766 1/20 0.35
KMO O15229 2/20 0.35
P2RX7 Q99572 1/20 0.34

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
SCHEMBL31336792 0.83 GABRA1 (0.38) JMJD6GRM5
SCHEMBL31336683 0.81 GRM5 (0.43) KDM4EPOLBALDH1A1GAAAPOBEC3A
SCHEMBL31336831 0.77 CCR1 (0.33) KDM4EPOLBALDH1A1KDM4CP2RX7
SCHEMBL31336692 0.76 KDM4E (0.39) KDM4EPOLBALDH1A1GAAAPOBEC3A
SCHEMBL19207031 0.74 HCRTR1 (0.42) KDM4EPOLBALDH1A1GAAAPOBEC3A
SCHEMBL31336740 0.73 POLB (0.50) KDM4EPOLBALDH1A1GAA
SCHEMBL19207132 0.72 MYC (0.41) KDM4EPOLBALDH1A1GAAAPOBEC3A
SCHEMBL31336654 0.72 GRM5 (0.38) GRM5
SCHEMBL31336650 0.71 HCAR2 (0.41) POLBGRM5
SCHEMBL23146956 0.71 POLB (0.40) KDM4EPOLBALDH1A1GAAGRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688154-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - Portela & Ca., S.A. (PT) 2026-02-11 EP claimed
WO-2025023851-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - PORTELA & CA., S.A. (PT) 2025-01-30 WO claimed
EP-4688154-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