SCHEMBL9862354

SCHEMBL9862354

CC1(O)CC[C@H]2C[C@H]1C2(C)C

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 1/20 0.37
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
RECQL P46063 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
SCHEMBL8241582 1.00 LMNA (0.37) LMNAMAPK1ALDH1A1THRBALOX15
SCHEMBL9862355 1.00 LMNA (0.37) LMNAMAPK1ALDH1A1THRBALOX15
SCHEMBL2826604 1.00 LMNA (0.37) LMNAMAPK1ALDH1A1THRBALOX15
SCHEMBL221185 1.00 LMNA (0.37) LMNAMAPK1ALDH1A1THRBALOX15
Water SCHEMBL890485 0.98 ALDH1A1 (0.36) LMNAMAPK1ALDH1A1THRBALOX15
Alcohol SCHEMBL11674015 0.92 ALDH1A1 (0.33) LMNAMAPK1ALDH1A1THRBALOX15
SCHEMBL1868393 0.77
SCHEMBL11504897 0.75 LMNA (0.32) LMNAMAPK1MAPTTSHRRECQL
SCHEMBL13400151 0.74
SCHEMBL9053737 0.74 LMNA (0.35) LMNASMN1; SMN2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991002711-A2 7,7-DIMETHYLNORBORNANE DERIVATIVES THE COCA-COLA COMPANY (US) 1991-03-07 WO disclosed