SCHEMBL7844206

SCHEMBL7844206

COC(=O)c1cnn(-c2ccc(NC(=O)OCc3ccccc3)cc2F)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.47
ROCK2 O75116 3/20 0.44
POLB P06746 1/20 0.43
SCD O00767 3/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
RAB9A P51151 1/20 0.43
ATM Q13315 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ENPP2 Q13822 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL3759889 0.93 NAMPT (0.48) MGLLPTGDR2ROCK2POLBSCD
SCHEMBL3753454 0.91 MGLL (0.49) MGLLPTGDR2ROCK2POLBSCD
SCHEMBL4011732 0.89 MGLL (0.47) MGLLPTGDR2ROCK2POLBSCD
SCHEMBL13054799 0.89 MGLL (0.44) MGLLPTGDR2ROCK2POLBSCD
SCHEMBL7843556 0.85 MGLL (0.47) MGLLPTGDR2ROCK2POLBSCD
SCHEMBL4012419 0.83 PTGDR2 (0.45) MGLLPTGDR2ROCK2POLBSCD
SCHEMBL13054802 0.81 PTGDR2 (0.44) MGLLPTGDR2ROCK2POLBSCD
SCHEMBL15710402 0.80 MGLL (0.45) MGLLPTGDR2ROCK2POLBSCD
SCHEMBL7830249 0.80 MGLL (0.52) MGLLPTGDR2ROCK2POLBSCD
SCHEMBL13939828 0.79 PTGDR2 (0.51) MGLLPTGDR2POLBSCDNPC1

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 5 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
EP-0807112-A1 HETERO-AROMATIC RING SUBSTITUTED PHENYLOXAZOLIDINONE ANTIMICROBIALS PHARMACIA & UPJOHN COMPANY (US) 1997-11-19 EP disclosed
WO-1996023788-A1 HETERO-AROMATIC RING SUBSTITUTED PHENYLOXAZOLIDINONE ANTIMICROBIALS PHARMACIA + UPJOHN COMPANY (US) 1996-08-08 WO disclosed