SCHEMBL30929950

SCHEMBL30929950

COC(=O)c1ccc(COc2ccc3cc(-c4ccccc4)ccc3c2-c2c(OCc3ccc(C(=O)OC)c4ccccc34)ccc3cc(-c4ccccc4)ccc23)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.46
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
NR4A2 P43354 2/20 0.41
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
DHODH Q02127 1/20 0.40
PLA2G2A P14555 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
PARP15 Q460N3 1/20 0.39
PARP10 Q53GL7 1/20 0.39
MTNR1A P48039 1/20 0.38
MTNR1B P49286 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
SCHEMBL30929987 0.95 FDPS (0.47) FDPSKDM4EALDH1A1HPGDNPSR1
SCHEMBL30929963 0.95 SLC6A3 (0.47) FDPSKDM4EALDH1A1HPGDNPSR1
SCHEMBL30929977 0.90 SLC6A3 (0.49) FDPSKDM4EALDH1A1HPGDNPSR1
SCHEMBL32684338 0.87 PARP15 (0.46) FDPSKDM4EALDH1A1HPGDNPSR1
SCHEMBL32684725 0.81 MEN1 (0.53) FDPSKDM4EALDH1A1HPGDNPSR1
SCHEMBL30929976 0.80 SMPD1 (0.54) HPGDMEN1MAPTKMT2ASMPD1
SCHEMBL30929972 0.78 SMPD1 (0.49) MAPTSMPD1ERN1
SCHEMBL30929975 0.78 MRGPRX4 (0.56) NR4A2ERN1
SCHEMBL30929968 0.78 PLAU (0.46) FDPSKDM4EALDH1A1HPGDMAPT
SCHEMBL26582597 0.76 MAPT (0.62) KDM4EALDH1A1MEN1MAPTKMT2A

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-2024115460-A1 BINAPHTHYL COMPOUNDS AND THERMOPLASTIC RESINS REUTER CHEMISCHE APPARATEBAU E.K. (DE) 2024-06-06 WO disclosed