SCHEMBL28518355

SCHEMBL28518355

O=C(/C=C/c1ccc(/C=C2\SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)cc1)c1ccc(OCc2ccccc2F)cc1

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BCL2L2 Q92843 6/20 0.66
▸ BAD Q92934 6/20 0.66
▸ BCL2 P10415 5/20 0.66
▸ MME P08473 2/20 0.61
▸ MAPT P10636 5/20 0.61
▸ MEN1 O00255 3/20 0.61
▸ KMT2A Q03164 3/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ CRHBP P24387 1/20 0.61
▸ CRHR2 Q13324 1/20 0.61
▸ L3MBTL1 Q9Y468 1/20 0.61
▸ PTPN1 P18031 5/20 0.57
▸ POLB P06746 2/20 0.57
▸ PLA2G1B P04054 1/20 0.57
▸ ATG4B Q9Y4P1 1/20 0.57
▸ ADAMTS5 Q9UNA0 1/20 0.57
▸ MAPK1 P28482 1/20 0.52
▸ RECQL P46063 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
SCHEMBL28518357 1.00 BCL2L2 (0.66) BCL2L2BADBCL2MMEMAPT
SCHEMBL28505342 0.91 BCL2L2 (0.66) BCL2L2BADBCL2MMEMAPT
SCHEMBL28505344 0.91 BCL2L2 (0.66) BCL2L2BADBCL2MMEMAPT
SCHEMBL28510321 0.90 BCL2L2 (0.67) BCL2L2BADBCL2MMEMAPT
SCHEMBL28510320 0.90 BCL2L2 (0.67) BCL2L2BADBCL2MMEMAPT
SCHEMBL28505299 0.90 BCL2L2 (0.66) BCL2L2BADBCL2MMEMAPT
SCHEMBL28505297 0.90 BCL2L2 (0.66) BCL2L2BADBCL2MMEMAPT
SCHEMBL28510316 0.87 BCL2L2 (0.67) BCL2L2BADBCL2MMEMAPT
SCHEMBL28506926 0.87 MAPT (0.70) BCL2L2BADBCL2MMEMAPT
SCHEMBL28506925 0.87 MAPT (0.70) BCL2L2BADBCL2MMEMAPT

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-109528716-B Application of chalcone compound containing carboxymethyl rhodanine structure 延边大学 2021-02-02 — — CN disclosed
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