SCHEMBL27369375

SCHEMBL27369375

NC(Cc1cnoc1-c1cccc(O)c1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 1/20 0.56
TPH1 P17752 2/20 0.43
KYNU Q16719 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
CYP3A4 P08684 2/20 0.41
MAPT P10636 2/20 0.41
ALOX15 P16050 2/20 0.41
NFKB1 P19838 2/20 0.41
BLM P54132 2/20 0.41
PMP22 Q01453 2/20 0.41
KMT2A Q03164 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HTR1A P08908 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
TSHR P16473 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 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
SCHEMBL25356410 0.72 GRIA2 (0.81) GRIA2TPH1KDM4ECYP3A4ALOX15
SCHEMBL31688735 0.72 GRIA2 (0.81) GRIA2TPH1KDM4ECYP3A4ALOX15
SCHEMBL25356408 0.72 GRIA2 (0.81) GRIA2TPH1KDM4ECYP3A4ALOX15
SCHEMBL31688759 0.71 GRIA2 (0.65) GRIA2TPH1KDM4EALOX15HSD17B10
SCHEMBL6422740 0.69 GRIA1 (0.49) GRIA2KDM4EALDH1A1LMNACYP3A4
SCHEMBL28677794 0.69 GRIA2 (0.55) GRIA2KDM4EALDH1A1LMNACYP3A4
SCHEMBL28677792 0.69 GRIA2 (0.55) GRIA2KDM4EALDH1A1LMNACYP3A4
SCHEMBL4356402 0.69 GRIA2 (0.82) GRIA2KDM4EALOX15HSD17B10ADORA3
SCHEMBL13537526 0.69 GRIA2 (0.82) GRIA2KDM4EALOX15HSD17B10ADORA3
SCHEMBL22721343 0.69 GRIA2 (0.82) GRIA2KDM4EALOX15HSD17B10ADORA3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1056837-C 5-arylisoxazol-4-yl-substituted 2-aminocarboxylic acid compounds LUNDBECK & CO AS H (DK) 2000-09-27 CN disclosed
CN-1136810-A 5-arylisoxazol-4-yl-substituted 2-aminocarboxylic acid compounds LUNDBECK & CO AS H (DK) 1996-11-27 CN disclosed