SCHEMBL11575263

SCHEMBL11575263

C=C(CCC=C(C)C)C1CC=C(C)CCC=C(C)CCC=C(C)CC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.51
ALOX15 P16050 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
CYP3A4 P08684 2/20 0.46
STAT3 P40763 2/20 0.46
MAPK1 P28482 1/20 0.46
CHRNA7 P36544 1/20 0.46
PTPN1 P18031 3/20 0.41
ALDH1A1 P00352 2/20 0.35
CYP1B1 Q16678 1/20 0.35
MAPT P10636 1/20 0.35
TRPA1 O75762 1/20 0.35
TSHR P16473 3/20 0.32
TP53 P04637 1/20 0.31
CNR2 P34972 1/20 0.31
PPARA Q07869 1/20 0.31

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
SCHEMBL11575262 1.00 LMNA (0.51) LMNAALOX15MEN1KMT2ACYP3A4
Bisabolone SCHEMBL83912 0.95 LMNA (0.57) LMNAALOX15MEN1KMT2ACYP3A4
Bisabolone SCHEMBL83913 0.95 LMNA (0.57) LMNAALOX15MEN1KMT2ACYP3A4
Bisabolone SCHEMBL159878 0.95 LMNA (0.57) LMNAALOX15MEN1KMT2ACYP3A4
SCHEMBL29388335 0.83 LMNA (0.53) LMNAALOX15MEN1KMT2ACYP3A4
SCHEMBL29618988 0.83 LMNA (0.53) LMNAALOX15MEN1KMT2ACYP3A4
SCHEMBL3826218 0.80 ALOX15 (0.52) LMNAALOX15MEN1KMT2ACYP3A4
SCHEMBL336314 0.79 LMNA (0.57) LMNAALOX15MEN1KMT2ACYP3A4
SCHEMBL336313 0.79 LMNA (0.57) LMNAALOX15MEN1KMT2ACYP3A4
SCHEMBL3024189 0.78 ALDH1A1 (0.61) LMNAALOX15MEN1KMT2ACYP3A4

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
JP-53137931-A None JP disclosed
JP-S53137931-A NOVEL CYCLIC SESTATERPENES MITSUBISHI CHEM IND LTD 1978-12-01 JP disclosed