SCHEMBL9224554

SCHEMBL9224554

CCCCCCCCCOc1ccc2cc(OCc3ccc(C(=O)OC[C@H](C)CC)cc3)ccc2c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.49
THRA P10827 1/20 0.47
PLA2G4B P0C869 3/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
STS P08842 3/20 0.43

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
SCHEMBL9227430 1.00 MAPT (0.49) MAPTTHRAPLA2G4BTP53TSHR
SCHEMBL9226456 1.00 MAPT (0.49) MAPTTHRAPLA2G4BTP53TSHR
SCHEMBL9225791 1.00 MAPT (0.49) MAPTTHRAPLA2G4BTP53TSHR
SCHEMBL9224152 1.00 MAPT (0.49) MAPTTHRAPLA2G4BTP53TSHR
SCHEMBL9227266 1.00 MAPT (0.49) MAPTTHRAPLA2G4BTP53TSHR
SCHEMBL9223277 1.00 MAPT (0.49) MAPTTHRAPLA2G4BTP53TSHR
SCHEMBL9226509 1.00 MAPT (0.49) MAPTTHRAPLA2G4BTP53TSHR
SCHEMBL9217745 1.00 MAPT (0.49) MAPTTHRAPLA2G4BTP53TSHR
SCHEMBL9219576 1.00 MAPT (0.49) MAPTTHRAPLA2G4BTP53TSHR
SCHEMBL9227047 1.00 MAPT (0.49) MAPTTHRAPLA2G4BTP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0332409-B1 Novel substituted naphthalene compounds and liquid crystal compositions containing same MITSUI PETROCHEMICAL IND (JP) 1995-05-24 EP disclosed
US-5053164-A For high speed switching MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-10-01 US disclosed
US-4943651-A Novel substitued naphthalene compounds and liquid crystal compositions containing same MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-07-24 US disclosed