Sugi Predict

Sugi Predict / Compounds / SCHEMBL31336807

SCHEMBL31336807

SCHEMBL31336807

C[C@@H]1OC(F)(F)C(=O)N(Cc2ccccc2)C1CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SMYD2 Q9NRG4 3/20 0.37
▸ HSD11B1 P28845 1/20 0.35
▸ ELANE P08246 2/20 0.33
▸ CTSG P08311 1/20 0.32
▸ PRTN3 P24158 1/20 0.32
▸ SMO Q99835 2/20 0.31
▸ EHMT2 Q96KQ7 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
SCHEMBL31336704 1.00 SMYD2 (0.37) SMYD2HSD11B1ELANECTSGPRTN3
SCHEMBL31372538 0.80 SMYD2 (0.39) SMYD2HSD11B1ELANESMOEHMT2
SCHEMBL31372647 0.80 SMYD2 (0.39) SMYD2HSD11B1ELANESMOEHMT2
SCHEMBL31336836 0.78 SMYD2 (0.36) SMYD2
SCHEMBL31336713 0.78 SMYD2 (0.36) SMYD2
SCHEMBL31336845 0.78 SMYD2 (0.35) SMYD2
SCHEMBL31336758 0.78 SMYD2 (0.35) SMYD2
SCHEMBL31336626 0.78 SMYD2 (0.35) SMYD2
SCHEMBL18961289 0.77 SMYD2 (0.38) SMYD2HSD11B1SMOEHMT2
SCHEMBL31336878 0.74 SMO (0.36) HSD11B1ELANECTSGPRTN3SMO

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 2 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 disclosed
WO-2025023851-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - PORTELA & CA., S.A. (PT) 2025-01-30 — — WO disclosed