SCHEMBL7830249

SCHEMBL7830249

O=C(Nc1ccc(-n2cccn2)c(F)c1)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.52
POLB P06746 1/20 0.51
PTGDR2 Q9Y5Y4 1/20 0.48
MAPT P10636 3/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 2/20 0.47
NPC1 O15118 1/20 0.47
TSHR P16473 1/20 0.47
RAB9A P51151 1/20 0.47
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SCD O00767 2/20 0.47
ENPP2 Q13822 2/20 0.45
ROCK2 O75116 3/20 0.44
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
PTPN1 P18031 1/20 0.43

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
SCHEMBL7837025 0.87 POLB (0.51) MGLLPOLBPTGDR2MAPTALDH1A1
SCHEMBL7840752 0.85 POLB (0.54) MGLLPOLBPTGDR2MAPTALDH1A1
SCHEMBL7831820 0.84 BLM (0.51) MGLLPOLBPTGDR2MAPTALDH1A1
SCHEMBL7839750 0.83 MGLL (0.54) MGLLPOLBPTGDR2MAPTALDH1A1
SCHEMBL7841588 0.83 POLB (0.54) MGLLPOLBPTGDR2MAPTALDH1A1
SCHEMBL7843556 0.82 MGLL (0.47) MGLLPOLBPTGDR2MAPTALDH1A1
SCHEMBL3753454 0.82 MGLL (0.49) MGLLPOLBPTGDR2MAPTALDH1A1
SCHEMBL15710963 0.81 PTGDR2 (0.46) MGLLPOLBPTGDR2MAPTALDH1A1
SCHEMBL4011732 0.81 MGLL (0.47) MGLLPOLBPTGDR2MAPTALDH1A1
SCHEMBL5232610 0.80 PTGDR2 (0.51) MGLLPOLBPTGDR2MAPTALDH1A1

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 8 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
EP-0944388-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-08-16 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
EP-0944388-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-09-29 EP 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-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed
WO-1996023788-A1 HETERO-AROMATIC RING SUBSTITUTED PHENYLOXAZOLIDINONE ANTIMICROBIALS PHARMACIA + UPJOHN COMPANY (US) 1996-08-08 WO disclosed