SCHEMBL31336719

SCHEMBL31336719

C[C@@H]1OC(F)(F)CN(C(=O)OC(C)(C)C)[C@@H]1CO

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.38
TACR1 P25103 6/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 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
SCHEMBL31336605 0.89 ALDH1A1 (0.32) NR1H2MEN1KMT2AUSP2SMN1; SMN2
SCHEMBL31336642 0.87 USP2 (0.30) USP2SMN1; SMN2
SCHEMBL31336629 0.79 ALDH1A1 (0.35) TACR1MEN1KMT2ASMN1; SMN2
SCHEMBL31336643 0.77 KDM4E (0.34) TACR1MEN1KMT2A
SCHEMBL31716641 0.75 NR1H2 (0.42) NR1H2TACR1MEN1KMT2AUSP2
SCHEMBL29134449 0.75 NR1H2 (0.42) NR1H2TACR1MEN1KMT2AUSP2
SCHEMBL29770799 0.75 NR1H2 (0.42) NR1H2TACR1MEN1KMT2AUSP2
SCHEMBL28839780 0.73 NR1H2 (0.38) NR1H2TACR1MEN1KMT2ACHRM2
SCHEMBL13765261 0.72 NR1H2 (0.40) NR1H2MEN1KMT2AUSP2SMN1; SMN2
SCHEMBL18259601 0.72 USP2 (0.41) NR1H2USP2SMN1; SMN2

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