SCHEMBL31440320

SCHEMBL31440320

CC(NC(=O)/C=C/c1ccc(O)cc1)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.71
MMP1 P03956 4/20 0.54
MMP2 P08253 4/20 0.54
MMP9 P14780 4/20 0.54
HDAC3 O15379 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
HDAC9 Q9UKV0 1/20 0.54
HDAC5 Q9UQL6 1/20 0.54
CA12 O43570 3/20 0.53
AKR1B10 O60218 3/20 0.53
CA1 P00915 3/20 0.53
CA2 P00918 3/20 0.53
AKR1B1 P15121 3/20 0.53

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
SCHEMBL1557401 1.00 SMN1; SMN2 (0.71) SMN1; SMN2MMP1MMP2MMP9HDAC3
SCHEMBL1559044 1.00 SMN1; SMN2 (0.71) SMN1; SMN2MMP1MMP2MMP9HDAC3
SCHEMBL28483777 0.87 SMN1; SMN2 (0.71) SMN1; SMN2MMP1MMP2MMP9TDP1
SCHEMBL28483776 0.87 SMN1; SMN2 (0.71) SMN1; SMN2MMP1MMP2MMP9TDP1
SCHEMBL22994501 0.87 SMN1; SMN2 (0.70) SMN1; SMN2MMP1MMP2MMP9HDAC3
SCHEMBL1558184 0.87 SMN1; SMN2 (0.70) SMN1; SMN2MMP1MMP2MMP9HDAC3
SCHEMBL1558185 0.87 SMN1; SMN2 (0.70) SMN1; SMN2MMP1MMP2MMP9HDAC3
SCHEMBL28253673 0.87 SMN1; SMN2 (0.70) SMN1; SMN2MMP1MMP2MMP9HDAC3
SCHEMBL1557349 0.87 SMN1; SMN2 (0.70) SMN1; SMN2MMP1MMP2MMP9HDAC3
SCHEMBL1557347 0.87 SMN1; SMN2 (0.70) SMN1; SMN2MMP1MMP2MMP9HDAC3

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
CN-113861268-B Cell penetrating peptides and methods of making and using the same 恩特拉达治疗学股份有限公司 2025-04-01 CN disclosed