SCHEMBL29657341

SCHEMBL29657341

CCCCCOc1ccc(OCCCCC)c(OCCCCC)c1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.53
LTA4H P09960 3/20 0.52
TSHR P16473 2/20 0.51
TP53 P04637 1/20 0.47
PLA2G4B P0C869 2/20 0.46
THRA P10827 1/20 0.46
THRB P10828 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
SCHEMBL2499383 1.00 NR5A1 (0.53) NR5A1LTA4HTSHRTP53PLA2G4B
SCHEMBL13412633 0.98 NR5A1 (0.56) NR5A1LTA4HTSHRTP53PLA2G4B
SCHEMBL29657323 0.96 LTA4H (0.48) NR5A1LTA4HTSHR
SCHEMBL1573623 0.96 LTA4H (0.48) NR5A1LTA4HTSHR
SCHEMBL19612480 0.89 PLA2G4B (0.58) NR5A1TSHRPLA2G4BTHRATHRB
SCHEMBL8560597 0.88 MAPT (0.49) LTA4HTP53
SCHEMBL14930189 0.87 INPPL1 (0.45) NR5A1LTA4HPLA2G4BTHRATHRB
SCHEMBL19612285 0.86 MAPT (0.53) TSHRPLA2G4BTHRATHRB
SCHEMBL14176650 0.85 NR5A1 (0.50) NR5A1LTA4HTSHRTP53PLA2G4B
SCHEMBL6736811 0.84 NR5A1 (0.46) NR5A1LTA4HTSHRTP53PLA2G4B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114621375-B Rubber with backbone and end-group functionalization 固特异轮胎和橡胶公司 2024-06-18 CN disclosed
CN-114621375-A Rubber with main chain and end group functionalization 固特异轮胎和橡胶公司 2022-06-14 CN disclosed