SCHEMBL11259490

SCHEMBL11259490

O=C(O)COc1c[nH]c(CO)cc1=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 7/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.38
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GLA P06280 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PKM P14618 1/20 0.36
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL11252689 0.86 TDP1 (0.41) PTGDR2MAPTTDP1POLBSMN1; SMN2
SCHEMBL11259706 0.80 L3MBTL1 (0.46) PTGDR2TDP1POLBSMN1; SMN2GLA
Water SCHEMBL11254358 0.79 L3MBTL1 (0.45) PTGDR2TDP1POLBSMN1; SMN2GLA
SCHEMBL71120 0.77 GSTP1 (0.44) MAPTTDP1POLBSMN1; SMN2L3MBTL1
SCHEMBL14818596 0.76 CDK1 (0.40) MAPTL3MBTL1
SCHEMBL71549 0.76 CDK1 (0.41) MAPT
SCHEMBL31541640 0.72 CDK1 (0.34)
SCHEMBL11250024 0.71 ALDH1A1 (0.47) PTGDR2MAPTTDP1POLBSMN1; SMN2
SCHEMBL106114 0.70 NPC1 (0.43) MAPTPOLBSMN1; SMN2
SCHEMBL11260288 0.70 MAPT (0.44) PTGDR2MAPTTDP1POLBSMN1; SMN2

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
US-4324892-A 7-(N-Substituted-2-phenylglycinamido)-3-substituted-3-cephem-4-carboxylic acid compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-04-13 US disclosed
US-4172198-A ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1979-10-23 US disclosed