SCHEMBL7840029

SCHEMBL7840029

O=C1OC(CO)CN1c1ccc(-n2cccc2)c(F)c1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 7/20 0.60
MAOB P27338 11/20 0.56
MAOA P21397 5/20 0.56
LMNA P02545 1/20 0.51
PTGS1 P23219 1/20 0.51
SDHA P31040 1/20 0.51
F10 P00742 1/20 0.48

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
SCHEMBL7840027 1.00 CALML3 (0.60) CALML3MAOBMAOALMNAPTGS1
SCHEMBL5327031 0.88 MAOB (0.49) CALML3MAOBMAOALMNAPTGS1
SCHEMBL5327022 0.88 MAOB (0.49) CALML3MAOBMAOALMNAPTGS1
SCHEMBL14898018 0.87 CALML3 (0.61) CALML3MAOBMAOALMNAPTGS1
SCHEMBL8111357 0.85 CALML3 (0.64) CALML3MAOBMAOALMNAPTGS1
SCHEMBL5832691 0.85 CALML3 (0.64) CALML3MAOBMAOALMNAPTGS1
SCHEMBL5832684 0.85 CALML3 (0.64) CALML3MAOBMAOALMNAPTGS1
SCHEMBL28109794 0.84 CALML3 (0.65) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7841802 0.84 MAOA (0.74) CALML3MAOBMAOALMNAPTGS1
SCHEMBL7841797 0.84 MAOA (0.74) CALML3MAOBMAOALMNAPTGS1

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-0807112-B1 HETERO-AROMATIC RING SUBSTITUTED PHENYLOXAZOLIDINONE ANTIMICROBIALS UPJOHN CO (US) 2001-09-05 EP disclosed
US-6124334-A A BACTERICIDE TREATING INFECTIONS CAUSED BY GRAM-POSITIVE AEROBIC BACTERIA SUCH AS STAPHYLOCOCCUS, STREPTOCOCCUS AND ENTEROCOCCUS AS WELL AS ANAEROBIC ORGANISMS SUCH AS BACTEROIDES AND CLOSTRIDIUM AND MYCOBACTERIDIUM PHARMACIA & UPJOHN COMPANY (US) 2000-09-26 US disclosed
US-5910504-A BACTERICIDES TREATING INFECTIONS PHARMACIA & UPJOHN (US) 1999-06-08 US disclosed
WO-1996023788-A1 HETERO-AROMATIC RING SUBSTITUTED PHENYLOXAZOLIDINONE ANTIMICROBIALS PHARMACIA + UPJOHN COMPANY (US) 1996-08-08 WO disclosed