SCHEMBL7836906

SCHEMBL7836906

Cn1c(=O)n(C)c2cc(NC(=O)OCc3ccccc3)ccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2B P29275 3/20 0.57
▸ ADORA3 P0DMS8 2/20 0.57
▸ ADORA2A P29274 2/20 0.57
▸ ADORA1 P30542 2/20 0.57
▸ SMN1; SMN2 Q16637 5/20 0.57
▸ TP53 P04637 2/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ ALDH1A1 P00352 3/20 0.55
▸ LMNA P02545 2/20 0.55
▸ HTT P42858 2/20 0.55
▸ MGLL Q99685 1/20 0.55
▸ BRPF1 P55201 2/20 0.54
▸ PKM P14618 1/20 0.54
▸ RAB9A P51151 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ ATM Q13315 1/20 0.53
▸ GAA P10253 1/20 0.52
▸ ROCK2 O75116 1/20 0.52

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
SCHEMBL7812540 0.81 MAPT (0.53) ADORA2BADORA3ADORA2AADORA1SMN1; SMN2
SCHEMBL5339818 0.77 NOTUM (0.57) SMN1; SMN2TP53ALDH1A1MGLLRAB9A
SCHEMBL6511478 0.75 MGLL (0.47) ADORA2BADORA3ADORA2AADORA1SMN1; SMN2
SCHEMBL6511479 0.75 MGLL (0.47) ADORA2BADORA3ADORA2AADORA1SMN1; SMN2
Benzyl Phenylcarbamate SCHEMBL1222943 0.74 POLB (0.78) SMN1; SMN2TP53ALDH1A1LMNAMGLL
SCHEMBL30207797 0.74 MGLL (0.65) SMN1; SMN2TP53ALDH1A1LMNAHTT
SCHEMBL4432278 0.74 MGLL (0.65) SMN1; SMN2TP53ALDH1A1LMNAHTT
SCHEMBL4202829 0.74 TP53 (0.52) SMN1; SMN2TP53ALDH1A1LMNAMGLL
SCHEMBL5852207 0.74 POLB (0.68) SMN1; SMN2TP53ALDH1A1MGLLRAB9A
SCHEMBL27562443 0.74 POLB (0.68) SMN1; SMN2TP53ALDH1A1MGLLRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0738726-B1 Heterobenzocyclopentane oxazolidinones having antibacterial activity BAYER AG (DE) 2001-09-26 — — EP disclosed
CN-1138582-A heteroatom-comtaining benzocyclopentane-oxazolidinones BAYER AG (DE) 1996-12-25 — — CN disclosed
EP-0738726-A1 Heterobenzocyclopentane oxazolidinones having antibacterial activity BAYER AG (DE) 1996-10-23 — — EP disclosed
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