SCHEMBL11804151

SCHEMBL11804151

CC(=O)C1C(C)(C)CC(=O)CC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 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
SCHEMBL31455072 0.81 APLNR (0.36) ALDH1A1KDM4EPOLBMAPTTSHR
SCHEMBL31455239 0.77 GAA (0.41) ALDH1A1KDM4EMAPTTSHR
SCHEMBL11803626 0.74 AKR1B10 (0.36)
SCHEMBL14825419 0.74 FFAR3 (0.35)
SCHEMBL14825423 0.70 UGT2B7 (0.35) MAPTTSHR
SCHEMBL17110217 0.70 AKR1B10 (0.36) ALDH1A1KDM4EMAPTTSHR
SCHEMBL11883753 0.69 MEN1 (0.32) ALDH1A1POLB
SCHEMBL23086228 0.67
SCHEMBL31455588 0.67 MAPT (0.33) ALDH1A1KDM4EPOLBMAPTTSHR
SCHEMBL273630 0.66 ALOX15 (0.34) ALDH1A1KDM4EPOLBMAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3953515-A PERFUMES SOCIETE ANONYME ROURE BERTRAND DUPONT (FR) 1976-04-27 US claimed
US-3948815-A DIKETONES CORBIER BERNARD PIERRE 1976-04-06 US claimed
US-3953516-A PERFUMES SOCIETE ANONYME ROURE BERTRAND DUPONT (FR) 1976-04-27 US disclosed
US-3953516-A PERFUMES SOCIETE ANONYME ROURE BERTRAND DUPONT (FR) 1976-04-27 US disclosed
US-3953515-A PERFUMES SOCIETE ANONYME ROURE BERTRAND DUPONT (FR) 1976-04-27 US disclosed
US-3953471-A PERFUMES SOCIETE ANONYME ROURE BERTRAND DUPONT (FR) 1976-04-27 US disclosed
US-3953471-A PERFUMES SOCIETE ANONYME ROURE BERTRAND DUPONT (FR) 1976-04-27 US disclosed
US-3948815-A DIKETONES CORBIER BERNARD PIERRE 1976-04-06 US disclosed