SCHEMBL29102439

SCHEMBL29102439

NC(=O)C=COBOc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 3/20 0.37
CTNNB1 P35222 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SLC1A3 P43003 1/20 0.34
MAP3K7 O43318 1/20 0.34
TAB1 Q15750 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HTT P42858 2/20 0.33
MAPT P10636 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 1/20 0.33
ALOX15 P16050 1/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
PARP1 P09874 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL6113933 0.72 CA4 (0.36) TSHR
SCHEMBL674382 0.72 PARP10 (0.42) PARP10CTNNB1MEN1KMT2ASMN1; SMN2
SCHEMBL711694 0.71 LMNA (0.36) KMT2AALDH1A1GAAALOX15TSHR
SCHEMBL9248781 0.68 HPGD (0.48) PARP10CTNNB1MEN1KMT2ASLC1A3
Acrylamide SCHEMBL1723260 0.68 THRB (0.41) PARP10CTNNB1MEN1KMT2ASMN1; SMN2
SCHEMBL28143256 0.67 CTNNB1 (0.42) PARP10CTNNB1KMT2ASMN1; SMN2HTT
SCHEMBL511745 0.67 TSHR (0.36) ALDH1A1ALOX15TSHRTDP1L3MBTL1
SCHEMBL8885 0.67 LTA4H (0.50) ALDH1A1ALOX15TSHRRECQLTDP1
SCHEMBL29102453 0.67 PARP10 (0.38) PARP10CTNNB1MEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL693111 0.65 LTA4H (0.47) MEN1KMT2AALDH1A1ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115811985-A Therapeutic hybrid microneedle patch for delivery of insulin and glucagon 加利福尼亚大学董事会 2023-03-17 CN claimed
CN-116802152-A Purification of bauxite ore using boric acid functionalized compounds 埃科莱布美国股份有限公司 2023-09-22 CN disclosed
CN-115811985-A Therapeutic hybrid microneedle patch for delivery of insulin and glucagon 加利福尼亚大学董事会 2023-03-17 CN disclosed