SCHEMBL25733769

SCHEMBL25733769

BCC(=O)NC(CC)COC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 4/20 0.44
TAS1R1 Q7RTX1 4/20 0.44
TAS1R2 Q8TE23 1/20 0.44
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP8 P22894 1/20 0.38
CA9 Q16790 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
NAMPT P43490 2/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
TLR2 O60603 1/20 0.34
ALOX15 P16050 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL20209145 0.90 TAS1R3 (0.34) TAS1R3TAS1R1TAS1R2HPGD
SCHEMBL25738440 0.85 TAS1R3 (0.33) TAS1R3TAS1R1TAS1R2
SCHEMBL26233842 0.85 TAS1R3 (0.32) TAS1R3TAS1R1TAS1R2
SCHEMBL7367893 0.84 TAS1R3 (0.46) TAS1R3TAS1R1TAS1R2CA12CA1
SCHEMBL23203605 0.81 TAS1R3 (0.31) TAS1R3TAS1R1TAS1R2
SCHEMBL23240831 0.80 ALDH1A1 (0.33) TAS1R3TAS1R1TAS1R2
SCHEMBL24872351 0.80 ALDH1A1 (0.32) TAS1R3TAS1R1TAS1R2HPGD
SCHEMBL27269180 0.80 ALDH1A1 (0.33) TAS1R3TAS1R1TAS1R2
SCHEMBL25719639 0.79 TAS1R3 (0.43) TAS1R3TAS1R1TAS1R2CA12CA1
SCHEMBL25650081 0.79

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
WO-2023109932-A1 DSRNA AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海拓界生物医药科技有限公司 2023-06-22 WO disclosed