SCHEMBL9766561

SCHEMBL9766561

CCCCCCCc1ccc(-c2ccccc2)c(C(=O)Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KAT8 Q9H7Z6 2/20 0.55
PPARA Q07869 2/20 0.51
RARB P10826 9/20 0.51
RARA P10276 2/20 0.50
RARG P13631 1/20 0.50
PPARG P37231 3/20 0.48
GPR3 P46089 1/20 0.47
FOLH1 Q04609 1/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
MTOR P42345 1/20 0.47
KMT2A Q03164 1/20 0.47
PLK1 P53350 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
SCHEMBL10395641 1.00 KAT8 (0.55) KAT8PPARARARBRARARARG
SCHEMBL7780583 0.89 KAT8 (0.65) KAT8PPARARARBRARARARG
SCHEMBL9766535 0.89 KAT8 (0.65) KAT8PPARARARBRARARARG
SCHEMBL4599432 0.89 KAT8 (0.65) KAT8PPARARARBRARARARG
Hydrochloric Acid SCHEMBL10395643 0.88 KAT8 (0.63) KAT8PPARARARBRARARARG
Hydrochloric Acid SCHEMBL9766562 0.88 KAT8 (0.63) KAT8PPARARARBRARARARG
SCHEMBL8509747 0.85 KAT8 (0.53) KAT8PPARARARBRARARARG
SCHEMBL3737185 0.83 FOLH1 (0.63) KAT8PPARARARBFOLH1
SCHEMBL18038416 0.81 PPARA (0.65) KAT8PPARARARBRARARARG
SCHEMBL9663460 0.80 KAT8 (0.68) KAT8PPARARARBRARARARG

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
US-5034152-A Liquid crystal 4-alkylbenzenethiols, ferroelectricity CANON KABUSHIKI KAISHA (JP) 1991-07-23 US disclosed
US-4816178-A Optically active compound and liquid crystal composition containing same CANON KABUSHIKI KAISHA (JP) 1989-03-28 US disclosed