SCHEMBL31191345

SCHEMBL31191345

CC(=O)N1CC2(CC2)c2ccc(OC(F)(F)F)cc21

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 5/20 0.55
▸ P2RY1 P47900 9/20 0.45
▸ XIAP P98170 1/20 0.41
▸ BIRC2 Q13490 1/20 0.41
▸ PDE4B Q07343 1/20 0.41
▸ AMPD2 Q01433 2/20 0.40

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
SCHEMBL31191390 0.84 P2RY1 (0.43) NOTUMP2RY1XIAPBIRC2PDE4B
SCHEMBL30039456 0.77 XIAP (0.58) NOTUMXIAPBIRC2
SCHEMBL14823131 0.76 NOTUM (0.65) NOTUMXIAPBIRC2
SCHEMBL17446870 0.76 NOTUM (0.57) NOTUMXIAPBIRC2
SCHEMBL10289631 0.76 NOTUM (0.60) NOTUMXIAPBIRC2AMPD2
SCHEMBL8957579 0.76 NOTUM (0.60) NOTUMXIAPBIRC2
SCHEMBL17436116 0.75 NOTUM (0.63) NOTUMXIAPBIRC2
SCHEMBL17636177 0.75 NOTUM (0.63) NOTUMXIAPBIRC2AMPD2
SCHEMBL10257474 0.75 NOTUM (0.63) NOTUMXIAPBIRC2
SCHEMBL31191380 0.75 PDE4B (0.41) NOTUMP2RY1XIAPBIRC2PDE4B

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-4720034-A1 NOVEL COMPOUNDS TO TREAT VIRAL INFECTIONS Zydus Lifesciences Limited (IN) 2026-04-08 — — EP disclosed
WO-2024252254-A1 NOVEL COMPOUNDS TO TREAT VIRAL INFECTIONS ZYDUS LIFESCIENCES LIMITED (IN) 2024-12-12 — — WO disclosed
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