SCHEMBL9750922

SCHEMBL9750922

Cc1c(C=CC=O)c(-c2ccc(F)cc2)c(C)n1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 4/20 0.55
PTGS2 P35354 3/20 0.37
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
AR P10275 1/20 0.34
RIPK3 Q9Y572 1/20 0.34
PTGS1 P23219 1/20 0.33

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
SCHEMBL9521513 1.00 HMGCR (0.55) HMGCRPTGS2POLBMEN1KMT2A
SCHEMBL9750902 0.87 HMGCR (0.46) HMGCRPTGS2MEN1KMT2AALDH1A1
SCHEMBL9750899 0.87 HMGCR (0.46) HMGCRPTGS2MEN1KMT2AALDH1A1
SCHEMBL9518519 0.86 HMGCR (0.54) HMGCRPTGS2POLBALDH1A1KDM4E
SCHEMBL9756864 0.77 HMGCR (0.38) HMGCRPTGS2MEN1KMT2AALDH1A1
SCHEMBL9756865 0.77 HMGCR (0.38) HMGCRPTGS2MEN1KMT2AALDH1A1
SCHEMBL9518289 0.75 HMGCR (0.47) HMGCRPTGS2POLBMEN1KMT2A
SCHEMBL9751007 0.75 HMGCR (0.56) HMGCRPTGS2POLBMEN1KMT2A
SCHEMBL9751002 0.75 HMGCR (0.56) HMGCRPTGS2POLBMEN1KMT2A
SCHEMBL6962562 0.73 MEN1 (0.41) HMGCRPTGS2POLBMEN1KMT2A

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