SCHEMBL9543819

SCHEMBL9543819

C=C(CCC1CC1)C1CC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
LMNA P02545 2/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
PLG P00747 1/20 0.30
PLAT P00750 1/20 0.30

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
SCHEMBL8218872 0.72 HTT (0.40) TP53LMNAMAPK1HTT
SCHEMBL8221950 0.71 CYP1A2 (0.43) TP53LMNAMAPK1HTT
SCHEMBL4826004 0.70
SCHEMBL11063696 0.70
SCHEMBL12889682 0.70 LMNA (0.38) THRATHRBLMNAMAPK1HTT
SCHEMBL5791003 0.70 LMNA (0.38) THRATHRBLMNAMAPK1HTT
SCHEMBL6185146 0.67 HTT (0.38) TP53THRATHRBLMNAMAPK1
SCHEMBL4836366 0.67
SCHEMBL24383316 0.66 HPGD (0.30)
SCHEMBL7524665 0.66 HTT (0.46) TP53LMNAMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5039229-A None JP disclosed
JP-4066542-A None JP disclosed
JP-H0539229-A PRODUCTION OF ALPHA-OLEFIN DIMER IDEMITSU KOSAN CO LTD 1993-02-19 JP disclosed
JP-H0466542-A HIGHER OLEFIN DIMER AND PRODUCTION THEREOF IDEMITSU KOSAN CO LTD 1992-03-02 JP disclosed