SCHEMBL4687356

SCHEMBL4687356

COC(=O)c1ccc(C(=O)NCC(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.62
KDM4E B2RXH2 1/20 0.62
HIF1A Q16665 1/20 0.62
SLC22A6 Q4U2R8 1/20 0.62
SLC22A8 Q8TCC7 1/20 0.62
POLB P06746 2/20 0.58
ATM Q13315 1/20 0.57
RAB9A P51151 1/20 0.56
CA1 P00915 4/20 0.56
CA2 P00918 4/20 0.56
KDM6B O15054 1/20 0.56
FTO Q9C0B1 1/20 0.56
EGLN1 Q9GZT9 1/20 0.56
HIF1AN Q9NWT6 1/20 0.56
TSHR P16473 1/20 0.53
SOST Q9BQB4 1/20 0.53
CA9 Q16790 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
CA12 O43570 1/20 0.52
CA7 P43166 1/20 0.52

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
SCHEMBL11107537 0.86 KDM4E (0.80) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL30838576 0.85 KDM4E (0.62) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL2796671 0.84 ALDH1A1 (0.67) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL3374934 0.83 SMN1; SMN2 (0.68) MAPTPOLBRAB9ATSHRMEN1
SCHEMBL25184674 0.83 SMN1; SMN2 (0.62) KDM4ERAB9ATSHRKMT2ASMN1; SMN2
SCHEMBL5561237 0.82 POLB (0.74) MAPTPOLBATMRAB9ACA1
SCHEMBL13760121 0.81 KDM4E (0.62) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL10652868 0.81 MAPT (0.66) MAPTPOLBATMRAB9ACA1
SCHEMBL1285723 0.81 KDM4E (0.67) MAPTKDM4EHIF1ASLC22A6SLC22A8
SCHEMBL17299366 0.81 KDM4E (0.67) MAPTKDM4EHIF1ASLC22A6SLC22A8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1581496-A4 2-SUBSTITUTED-3-PROPENAMIDE DERIVATIVES AND METHODS OF USING THE SAME GILEAD SCIENCES INC (US) 2008-04-23 EP disclosed
EP-1581496-A2 2-SUBSTITUTED-3-PROPENAMIDE DERIVATIVES AND METHODS OF USING THE SAME GILEAD SCIENCES, INC. (US) 2005-10-05 EP disclosed
WO-2004050613-A2 2-SUBSTITUTED-3-PROPENAMIDE DERIVATIVES AND METHODS OF USING THE SAME GILEAD SCIENCES, INC. (US) 2004-06-17 WO disclosed
WO-1998033501-A1 2-BENZOYLAMINO-3-PHENYLPROPENAMIDE DERIVATIVES AND METHODS OF USING THE SAME AVID THERAPEUTICS INC. (US) 1998-08-06 WO disclosed