SCHEMBL8306719

SCHEMBL8306719

O=C(COCc1ccccc1)NCN1CCOC1=O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 8/20 0.46
FAAH O00519 6/20 0.45
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KMT2A Q03164 1/20 0.44
TSHR P16473 1/20 0.43
NAMPT P43490 1/20 0.42
GRM5 P41594 2/20 0.41
PTPRC P08575 1/20 0.40
PTPN1 P18031 1/20 0.40

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
SCHEMBL9858241 0.77 NAAA (0.48) NAAAFAAHALDH1A1KMT2ATSHR
SCHEMBL3019770 0.75 PKM (0.49) NAAAFAAHALDH1A1LMNAPOLB
SCHEMBL11985467 0.73 NAAA (0.50) NAAAFAAHALDH1A1POLBKMT2A
SCHEMBL20715297 0.72 NAAA (0.47) NAAAFAAHALDH1A1KMT2ATSHR
SCHEMBL14112017 0.71 KMT2A (0.65) ALDH1A1MAPTKMT2ATSHR
SCHEMBL12561178 0.70 SMN1; SMN2 (0.54) ALDH1A1LMNAKMT2ATSHRNAMPT
SCHEMBL5213442 0.70 CSNK1D (0.48) ALDH1A1LMNAKMT2ATSHRNAMPT
SCHEMBL26333756 0.69 CSNK1D (0.50) ALDH1A1LMNATSHRNAMPTGRM5
SCHEMBL531434 0.69 GRM2 (0.52) NAAAFAAHPOLBKMT2A
SCHEMBL4877349 0.69 CSNK1D (0.48) ALDH1A1LMNAKMT2ATSHRNAMPT

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-0717738-B1 SUBSTITUTED OXAZINE AND THIAZINE OXAZOLIDINONE ANTIMICROBIALS UPJOHN CO (US) 1999-10-20 EP disclosed
US-5880118-A Substituted oxazine and thiazine oxazolidinone antimicrobials PHARMACIA & UPJOHN COMPANY (US) 1999-03-09 US disclosed
US-5688792-A BACTERICIDES PHARMACIA & UPJOHN COMPANY (US) 1997-11-18 US disclosed