SCHEMBL29178205

SCHEMBL29178205

NC(=O)C1CC2CC1CC2C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 2/20 0.39
▸ GABRR1 P24046 1/20 0.35

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
SCHEMBL22604587 0.94 EPHX1 (0.39) EPHX1GABRR1
SCHEMBL3918742 0.87 EPHX1 (0.32) EPHX1
SCHEMBL13533362 0.85 EPHX1 (0.45) EPHX1
SCHEMBL1659517 0.83 LMNA (0.38) EPHX1
SCHEMBL277846 0.76 EPHX1 (0.50) EPHX1GABRR1
SCHEMBL22546507 0.76 — —
SCHEMBL38651938 0.76 EPHX1 (0.50) EPHX1GABRR1
SCHEMBL20876415 0.76 — —
SCHEMBL38651937 0.76 EPHX1 (0.50) EPHX1GABRR1
SCHEMBL1076013 0.76 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117776939-A Diamine containing cyclohexane and norbornane structure, preparation method and application thereof in preparation of transparent nylon 万华化学集团股份有限公司 2024-03-29 — — CN disclosed
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