SCHEMBL6530208

SCHEMBL6530208

CN1C(=O)CCc2cc(NC(=O)OCc3ccccc3)ccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.52
TYRO3 Q06418 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 1/20 0.51
ALDH1A1 P00352 1/20 0.51
TP53 P04637 1/20 0.51
MAPT P10636 1/20 0.51
TSHR P16473 1/20 0.51
RAB9A P51151 1/20 0.51
ATM Q13315 1/20 0.51
MGLL Q99685 3/20 0.50
PSEN1 P49768 1/20 0.48
PSEN2 P49810 1/20 0.48
APH1B Q8WW43 1/20 0.48
NCSTN Q92542 1/20 0.48
APH1A Q96BI3 1/20 0.48
PSENEN Q9NZ42 1/20 0.48
ROCK2 O75116 2/20 0.47
POLB P06746 1/20 0.46
CYP19A1 P11511 1/20 0.46

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
SCHEMBL6529620 0.88 SMN1; SMN2 (0.50) SMN1; SMN2NPC1ALDH1A1TP53MAPT
SCHEMBL8116977 0.86 TSHR (0.48) SMN1; SMN2NPC1ALDH1A1TP53MAPT
SCHEMBL6530292 0.84 SMN1; SMN2 (0.47) SMN1; SMN2NPC1ALDH1A1TP53MAPT
SCHEMBL6530293 0.84 SMN1; SMN2 (0.47) SMN1; SMN2NPC1ALDH1A1TP53MAPT
SCHEMBL8132914 0.83 SMN1; SMN2 (0.50) SMN1; SMN2NPC1ALDH1A1TP53MAPT
SCHEMBL3831190 0.83 SMN1; SMN2 (0.55) SMN1; SMN2NPC1ALDH1A1TP53MAPT
SCHEMBL6528641 0.83 MAPT (0.50) SMN1; SMN2NPC1ALDH1A1TP53MAPT
SCHEMBL6191868 0.81 NPC1 (0.57) SMN1; SMN2NPC1ALDH1A1TP53MAPT
SCHEMBL6532124 0.81 NPC1 (0.60) SMN1; SMN2NPC1ALDH1A1TP53MAPT
SCHEMBL20809837 0.78 TP53 (0.56) SMN1; SMN2NPC1ALDH1A1TP53MAPT

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
WO-2005082897-A1 OXAZOLIDINONE ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2005-09-09 WO disclosed
EP-1049692-A1 NOVEL BICYCLENE-SUBSTITUTED OXAZOLIDINONES Bayer Aktiengesellschaft (DE) 2000-11-08 EP disclosed
WO-1999037641-A1 NOVEL BICYCLENE-SUBSTITUTED OXAZOLIDINONES BAYER AKTIENGESELLSCHAFT (DE) 1999-07-29 WO disclosed