SCHEMBL24085799

SCHEMBL24085799

CC(=O)N1CCC2C=CC=NC2C1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 1/20 0.32
▸ QDPR P09417 1/20 0.31
▸ EPHX2 P34913 2/20 0.31
▸ EPHX1 P07099 1/20 0.31
▸ JAK1 P23458 1/20 0.30
▸ JAK3 P52333 1/20 0.30
▸ CHRNB2 P17787 1/20 0.30
▸ CHRNA3 P32297 1/20 0.30
▸ CHRNA4 P43681 1/20 0.30
▸ CHRNB3 Q05901 1/20 0.30
▸ CHRNA6 Q15825 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
SCHEMBL12724717 0.65 MRGPRX2 (0.36) —
SCHEMBL18977623 0.64 — —
SCHEMBL16617716 0.64 QDPR (0.32) TDO2QDPREPHX2EPHX1CHRNB2
SCHEMBL1790270 0.63 — —
SCHEMBL8747062 0.62 MRGPRX2 (0.38) TDO2QDPREPHX2EPHX1
SCHEMBL50397 0.62 — —
SCHEMBL5017011 0.62 — —
SCHEMBL6277604 0.62 — —
SCHEMBL12142184 0.62 — —
SCHEMBL14996198 0.62 — —

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
EP-3444238-B1 PROCESS FOR PREPARING DIFLUOROMETHYLENE COMPOUNDS SATO PHARMA (JP) 2021-12-08 — — EP disclosed
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