SCHEMBL30929976

SCHEMBL30929976

COC(=O)c1ccc(COc2ccc3cc(-c4ccccc4)ccc3c2-c2c(OCc3ccc(C(=O)OC)cc3)ccc3cc(-c4ccccc4)ccc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.54
MAPT P10636 4/20 0.49
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
LMNA P02545 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
EGFR P00533 1/20 0.48
HPGD P15428 1/20 0.45
GPR84 Q9NQS5 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.45
CYP19A1 P11511 1/20 0.45
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL30929964 0.94 MAPT (0.49) SMPD1MAPTRAB9ASMN1; SMN2MEN1
SCHEMBL30929972 0.94 SMPD1 (0.49) SMPD1MAPTRAB9AEGFRMRGPRX4
SCHEMBL30929975 0.89 MRGPRX4 (0.56) MRGPRX4
SCHEMBL30929974 0.88 PLAU (0.47) SMPD1MAPTRAB9ASMN1; SMN2CYP1A2
SCHEMBL30929949 0.85 MAPT (0.55) MAPTRAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL30929969 0.83 MRGPRX4 (0.51) MAPTRAB9ASMN1; SMN2MRGPRX4TDP1
SCHEMBL30929968 0.80 PLAU (0.46) SMPD1MAPTRAB9ASMN1; SMN2HPGD
SCHEMBL30929950 0.80 FDPS (0.46) SMPD1MAPTMEN1KMT2AHPGD
SCHEMBL27395439 0.79 RAB9A (0.68) MAPTRAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL32684340 0.79 MAPT (0.48) MAPTRAB9ASMN1; SMN2MEN1KMT2A

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