SCHEMBL30929975

SCHEMBL30929975

COC(=O)c1cccc(COc2ccc3cc(-c4ccccc4)ccc3c2-c2c(OCc3cccc(C(=O)OC)c3)ccc3cc(-c4ccccc4)ccc23)c1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 13/20 0.56
ERN1 O75460 1/20 0.49
ADAMTS4 O75173 1/20 0.48
MMP13 P45452 1/20 0.48
NR4A2 P43354 1/20 0.47
PLAU P00749 2/20 0.47
FFAR1 O14842 1/20 0.46
PPARD Q03181 1/20 0.46

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
SCHEMBL30929969 0.95 MRGPRX4 (0.51) MRGPRX4ERN1PLAU
SCHEMBL30929972 0.92 SMPD1 (0.49) MRGPRX4ERN1PLAUPPARD
SCHEMBL30929976 0.89 SMPD1 (0.54) MRGPRX4
SCHEMBL30929966 0.87 MRGPRX4 (0.58) MRGPRX4
SCHEMBL30929974 0.86 PLAU (0.47) ERN1PLAU
SCHEMBL30929964 0.84 MAPT (0.49) PLAU
SCHEMBL8157075 0.81 MRGPRX4 (0.70) MRGPRX4ADAMTS4MMP13NR4A2FFAR1
SCHEMBL30929968 0.81 PLAU (0.46) MRGPRX4PLAU
SCHEMBL30929987 0.79 FDPS (0.47) MRGPRX4ERN1NR4A2
SCHEMBL30929950 0.78 FDPS (0.46) ERN1NR4A2

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