SCHEMBL4359381

SCHEMBL4359381

CC(COC(=O)C(C)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)OC(=O)C(C)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.38
GPR55 Q9Y2T6 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
LMNA P02545 1/20 0.37
RECQL P46063 1/20 0.37
CA2 P00918 3/20 0.37
CA1 P00915 2/20 0.37
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CACNA1A O00555 1/20 0.36
CACNA2D1 P54289 1/20 0.36
CACNB1 Q02641 1/20 0.36
PTGS1 P23219 2/20 0.36
PTGS2 P35354 2/20 0.36
ALOX5 P09917 1/20 0.36
POLB P06746 1/20 0.36
TYR P14679 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL11146904 0.86 HMGCR (0.36) HMGCRGPR55CYP1A2CYP2D6LMNA
SCHEMBL7021816 0.85 HMGCR (0.36) HMGCRGPR55CYP1A2CYP2D6LMNA
SCHEMBL4784134 0.83 TDP1 (0.44) HMGCRGPR55CYP1A2CYP2D6LMNA
SCHEMBL6056065 0.83 CA2 (0.42) HMGCRGPR55CYP1A2CYP2D6LMNA
SCHEMBL490322 0.82 HMGCR (0.44) HMGCRGPR55CYP1A2CYP2D6LMNA
SCHEMBL30559748 0.82 HMGCR (0.44) HMGCRGPR55CYP1A2CYP2D6LMNA
SCHEMBL5492112 0.82 CYP1A2 (0.42) HMGCRGPR55CYP1A2CYP2D6LMNA
SCHEMBL6396663 0.81 CYP1A2 (0.43) HMGCRGPR55CYP1A2CYP2D6LMNA
SCHEMBL4776164 0.81 HMGCR (0.40) HMGCRGPR55CYP1A2CYP2D6LMNA
SCHEMBL4453160 0.81 CA2 (0.40) HMGCRGPR55CYP1A2CYP2D6LMNA

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-20090251643-A1 POLARIZING PLATE, MANUFACTURING METHOD OF POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY APPARATUS KONICA MINOLTA OPTO, INC. (JP) 2009-10-08 US disclosed