SCHEMBL8399633

SCHEMBL8399633

CC(C)CCCCCCCCCCCC=CC=CC=CC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.55
MAPT P10636 1/20 0.55
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
PPARA Q07869 1/20 0.45
PTPN1 P18031 1/20 0.44
PPARG P37231 2/20 0.43
GPR132 Q9UNW8 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL30239801 1.00 ALDH1A1 (0.55) ALDH1A1MAPTCNR1CNR2PPARA
SCHEMBL3712279 1.00 ALDH1A1 (0.55) ALDH1A1MAPTCNR1CNR2PPARA
SCHEMBL5744794 0.98 ALDH1A1 (0.57) ALDH1A1MAPTCNR1CNR2PPARA
SCHEMBL26624583 0.98 ALDH1A1 (0.57) ALDH1A1MAPTCNR1CNR2PPARA
SCHEMBL16949678 0.98 ALDH1A1 (0.57) ALDH1A1MAPTCNR1CNR2PPARA
SCHEMBL5744792 0.98 ALDH1A1 (0.57) ALDH1A1MAPTCNR1CNR2PPARA
SCHEMBL16949679 0.98 ALDH1A1 (0.57) ALDH1A1MAPTCNR1CNR2PPARA
SCHEMBL25332112 0.88 MAPT (0.71) ALDH1A1MAPTCNR1CNR2PPARA
SCHEMBL5443913 0.88 MAPT (0.71) ALDH1A1MAPTCNR1CNR2PPARA
SCHEMBL2512265 0.88 MAPT (0.71) ALDH1A1MAPTCNR1CNR2PPARA

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-5914347-A BY ADDING TO A HYDROXYALKYL CELLULOSE, EVAPORATING THE SOLUTION OR DISPERSION TO DRYNESS UNDER AN INERT ATMOSPHERE TO PREPARE A POWDER; IMPARTS OXIDATION RESISTANCE GRINDA JEAN-ROBERT (FR) 1999-06-22 US disclosed