SCHEMBL17506705

SCHEMBL17506705

CC[C@H](COC)NC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 3/20 0.47
TAS1R1 Q7RTX1 3/20 0.47
TAS1R2 Q8TE23 1/20 0.47
PLA2G2C Q5R387 7/20 0.46
ACACB O00763 2/20 0.46
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA9 Q16790 2/20 0.42
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP8 P22894 1/20 0.42
PLA2G2A P14555 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CACNA1C Q13936 1/20 0.39

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
SCHEMBL13888611 1.00 TAS1R3 (0.47) TAS1R3TAS1R1TAS1R2PLA2G2CACACB
SCHEMBL22083015 0.89 PLA2G2C (0.46) TAS1R3TAS1R1TAS1R2PLA2G2CACACB
SCHEMBL19983067 0.83 MMP1 (0.44) TAS1R3TAS1R1TAS1R2PLA2G2CACACB
SCHEMBL12820064 0.83 PLA2G2C (0.56) TAS1R3TAS1R1PLA2G2CACACBPLA2G2A
SCHEMBL18221484 0.83 PLA2G2C (0.43) TAS1R3TAS1R1TAS1R2PLA2G2CACACB
SCHEMBL15780011 0.83 PLA2G2C (0.43) TAS1R3TAS1R1TAS1R2PLA2G2CACACB
SCHEMBL422585 0.81
SCHEMBL7367893 0.81 TAS1R3 (0.46) TAS1R3TAS1R1TAS1R2CA12CA1
SCHEMBL24124368 0.80 PLA2G2C (0.71) TAS1R3TAS1R1PLA2G2CACACBCA1
SCHEMBL7595685 0.80 TAS1R3 (0.43) TAS1R3TAS1R1TAS1R2PLA2G2CACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2982686-A1 POLYPEPTIDE HAVING SIALYLATED SUGAR CHAINS ATTACHED THERETO Glytech, Inc. (JP) 2016-02-10 EP disclosed