SCHEMBL30363373

SCHEMBL30363373

COC(=O)[C@@H]1[C@@H](C(=O)OC)[C@H]2C=C[C@@H]1C2

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
POLB P06746 2/20 0.44
HTT P42858 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PPM1B O75688 1/20 0.39
PTPN1 P18031 1/20 0.39
PPP1CC P36873 1/20 0.39
PKM P14618 1/20 0.39
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL5732376 1.00 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBHTTKDM4E
SCHEMBL7197213 1.00 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBHTTKDM4E
SCHEMBL18461270 1.00 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBHTTKDM4E
SCHEMBL147771 1.00 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBHTTKDM4E
SCHEMBL14827588 1.00 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBHTTKDM4E
SCHEMBL28062749 1.00 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBHTTKDM4E
SCHEMBL31042709 0.94 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBHTTKDM4E
SCHEMBL1286040 0.92 POLB (0.56) ALDH1A1SMN1; SMN2POLBHTTKDM4E
SCHEMBL392898 0.92 POLB (0.56) ALDH1A1SMN1; SMN2POLBHTTKDM4E
SCHEMBL960068 0.92 POLB (0.56) ALDH1A1SMN1; SMN2POLBHTTKDM4E

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
EP-2608949-B1 VARTM FLOW MODIFICATIONS FOR LOW VISCOSITY RESIN SYSTEMS MATERIA INC (US) 2023-03-29 EP disclosed