SCHEMBL8098112

SCHEMBL8098112

[c]1ccc(C23CCC(CC2)CC3)cc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.32
ALDH1A1 P00352 1/20 0.30
LMNA P02545 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
SCHEMBL548018 0.86 ALDH1A1 (0.36) ALDH1A1LMNA
SCHEMBL21220794 0.78 LMNA (0.45) ALDH1A1LMNA
SCHEMBL67257 0.74 LMNA (0.57) ALDH1A1LMNA
SCHEMBL22347856 0.71 KMT2A (0.42) PNMTALDH1A1LMNA
SCHEMBL8747878 0.70 PNMT (0.32) PNMT
SCHEMBL19691488 0.70
SCHEMBL22348038 0.70 ESR2 (0.39) ALDH1A1LMNA
SCHEMBL7026052 0.67 PNMT (0.31) PNMT
SCHEMBL22348080 0.67 HPGD (0.36) ALDH1A1LMNA
SCHEMBL23071388 0.66 GRIN2D (0.33) ALDH1A1LMNA

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-0792883-B1 Novel derivates of boronic acid, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-12-20 EP claimed
EP-0792883-A1 Novel derivates of boronic acid, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1997-09-03 EP claimed
EP-0792883-B1 Novel derivates of boronic acid, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-12-20 EP disclosed
EP-0792883-A1 Novel derivates of boronic acid, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1997-09-03 EP disclosed