SCHEMBL9750820

SCHEMBL9750820

CCOC(=O)c1c(-c2ccc(F)cc2)c(C)n(-c2ccccc2)c1C

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.71
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 3/20 0.50
GAA P10253 3/20 0.50
MAPT P10636 3/20 0.50
KDM4E B2RXH2 2/20 0.50
HPGD P15428 2/20 0.50
TSHR P16473 1/20 0.49
TP53 P04637 2/20 0.48
THRB P10828 2/20 0.48
PDE4D Q08499 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 1/20 0.48
LMNA P02545 1/20 0.48
RAB9A P51151 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HMGCR P04035 2/20 0.47
RECQL P46063 1/20 0.46

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
SCHEMBL9518354 0.81 AR (0.48) ARMEN1KMT2AALDH1A1GAA
SCHEMBL22730883 0.80 ALDH1A1 (0.60) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL11789135 0.79 POLB (0.51) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL11789226 0.78 MAPT (0.60) ARMEN1KMT2AALDH1A1GAA
SCHEMBL2884407 0.77 CHRNA7 (0.72) ALDH1A1MAPTHPGDTSHRTP53
SCHEMBL1717101 0.75 RECQL (0.55) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL1717801 0.75 MEN1 (0.60) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL1717992 0.75 MEN1 (0.60) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL2882459 0.75 ALDH1A1 (0.46) ARMEN1KMT2AALDH1A1GAA
SCHEMBL2884107 0.75 ALDH1A1 (0.46) ARMEN1KMT2AALDH1A1GAA

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-5055484-A Anticholesterol and antilipemic agent HOECHST AKTIENGESELLSCHAFT (DE) 1991-10-08 US disclosed