SCHEMBL31662686

SCHEMBL31662686

CCC(C)(O)CNC(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
CA1 P00915 4/20 0.39
CA12 O43570 4/20 0.39
CA7 P43166 2/20 0.39
CA14 Q9ULX7 2/20 0.39
CA2 P00918 4/20 0.38
CTSS P25774 3/20 0.38
CTSK P43235 3/20 0.38
CA9 Q16790 2/20 0.38
EPHX1 P07099 1/20 0.38
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
APLNR P35414 1/20 0.35

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
SCHEMBL842921 0.83 TDP1 (0.52) TDP1MEN1KMT2AGAAMAOA
SCHEMBL22241710 0.82 TDP1 (0.44) TDP1MEN1KMT2AGAAMAOA
SCHEMBL10049407 0.82 TDP1 (0.47) TDP1MEN1KMT2AGAAMAOA
SCHEMBL22604590 0.82 TDP1 (0.47) TDP1MEN1KMT2AGAAMAOA
SCHEMBL1105697 0.82 TDP1 (0.47) TDP1MEN1KMT2AGAAMAOA
SCHEMBL26862839 0.81 TDP1 (0.50) TDP1MEN1KMT2AGAAMAOA
SCHEMBL16266905 0.81 TDP1 (0.50) TDP1MEN1KMT2AGAAMAOA
SCHEMBL2374951 0.81 HMGCR (0.50) TDP1MEN1KMT2AGAAMAOA
SCHEMBL1536313 0.81 HMGCR (0.50) TDP1MEN1KMT2AGAAMAOA
SCHEMBL25596507 0.81 TDP1 (0.51) TDP1MEN1KMT2AGAAMAOA

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-2025151449-A1 BIFUNCTIONAL P53-BINDING COMPOUNDS AND USES THEREOF PHOTYS THERAPEUTICS, INC. (US) 2025-07-17 WO disclosed