SCHEMBL11834828

SCHEMBL11834828

CCC1CC(=O)CC(C)(C)C1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CYP2C19 P33261 1/20 0.31
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 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
SCHEMBL19816797 0.79 MAPT (0.30) MAPT
SCHEMBL11845653 0.76 ALDH1A1 (0.32) ALDH1A1
SCHEMBL10792327 0.75 MAPT (0.39) MAPTKDM4ELMNACYP2C19ALDH1A1
SCHEMBL10204415 0.74
SCHEMBL27672693 0.74
SCHEMBL2690863 0.73
SCHEMBL27781831 0.73 ALDH1A1 (0.42) MAPTKDM4ELMNAALDH1A1ALOX15
SCHEMBL4868570 0.73 ALDH1A1 (0.42) MAPTKDM4ELMNAALDH1A1ALOX15
SCHEMBL24862 0.73 ALDH1A1 (0.42) MAPTKDM4ELMNAALDH1A1ALOX15
SCHEMBL11484280 0.71 L3MBTL1 (0.40) MAPTALDH1A1

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
US-3954984-A ANTISECRETRETORY AGENTS, CENTRAL NERVOUS SYSTEM DEPRESSANTS RICHARDSON-MERRELL INC. (US) 1976-05-04 US disclosed