SCHEMBL7575977

SCHEMBL7575977

O=C(O)C(Nc1ccccc1O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
CYP2D6 P10635 1/20 0.42
SRC P12931 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
LMNA P02545 4/20 0.42
NPC1 O15118 2/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.41
MAPK1 P28482 1/20 0.41
HPGD P15428 2/20 0.41
FPR2 P25090 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 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
SCHEMBL7575575 0.80 KCNMA1 (0.54) MEN1KMT2ALMNANPC1TP53
SCHEMBL2483409 0.80 RAB9A (0.48) GAACYP2D6NPC1HTTRAB9A
SCHEMBL13241014 0.80 GAA (0.50) GAAMEN1KMT2ACYP2D6LMNA
SCHEMBL7574899 0.80 CYP2D6 (0.41) GAAMEN1KMT2ACYP2D6SRC
SCHEMBL2484664 0.80 GAA (0.50) GAAMEN1KMT2ACYP2D6LMNA
SCHEMBL7582089 0.80 FPR2 (0.46) MEN1KMT2ACYP2D6SRCCA1
SCHEMBL6244215 0.80 KCNQ2 (0.53) GAAMEN1KMT2ACYP2D6SRC
SCHEMBL16664407 0.80 GAA (0.50) GAAMEN1KMT2ACYP2D6LMNA
Hydrochloric Acid SCHEMBL2486567 0.79 GAA (0.49) GAAMEN1KMT2ALMNANPC1
Hydrochloric Acid SCHEMBL1695958 0.79 RAB9A (0.47) GAACYP2D6LMNANPC1HTT

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
CN-113818033-B Electrochemical synthesis method of 2-substituted benzoxazole derivative 诚达药业股份有限公司 2022-10-14 CN disclosed
EP-1242069-A2 ALBUMIN-BINDING COMPOUNDS THAT PREVENT NONENZYMATIC GLYCATION AND THAT MAY BE USED FOR TREATMENT OF GLYCATION-RELATED PATHOLOGIES EXOCELL, INC. (US) 2002-09-25 EP disclosed
WO-2001003684-A2 ALBUMIN-BINDING COMPOUNDS THAT PREVENT NONENZYMATIC GLYCATION AND THAT MAY BE USED FOR TREATMENT OF GLYCATION-RELATED PATHOLOGIES EXOCELL, INC. (US) 2001-01-18 WO disclosed