SCHEMBL9726514

SCHEMBL9726514

Cc1cc(C(=C(/C=C/C=O)c2nnnn2C)c2ccc(F)c(C)c2)ccc1F

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.46
SRC P12931 2/20 0.36
PIM1 P11309 1/20 0.33
HTR7 P34969 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL9726519 1.00 HMGCR (0.46) HMGCRSRCPIM1HTR7KMT2A
SCHEMBL9726563 0.88 HMGCR (0.44) HMGCRSRCPIM1HTR7
SCHEMBL9726481 0.84 HMGCR (0.57) HMGCR
SCHEMBL9726476 0.84 HMGCR (0.57) HMGCR
SCHEMBL9726462 0.82 HMGCR (0.43) HMGCR
SCHEMBL9726457 0.82 HMGCR (0.43) HMGCR
SCHEMBL9726717 0.81 HMGCR (0.53) HMGCR
SCHEMBL9727128 0.81 HMGCR (0.53) HMGCR
SCHEMBL9727124 0.81 HMGCR (0.53) HMGCR
SCHEMBL9799413 0.80 HMGCR (0.55) HMGCR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5110940-A Inhibitors of 3-hydroxy-3-methylglutaryl coenzyme A reductase BRISTOL-MYERS COMPANY (US) 1992-05-05 US claimed
WO-1988006584-A1 ANTIHYPERCHOLESTEROLEMIC TETRAZOLE COMPOUNDS BRISTOL-MYERS COMPANY (US) 1988-09-07 WO claimed
US-5110940-A Inhibitors of 3-hydroxy-3-methylglutaryl coenzyme A reductase BRISTOL-MYERS COMPANY (US) 1992-05-05 US disclosed
US-5068346-A Anticholesterol agents BRISTOL-MYERS COMPANY (US) 1991-11-26 US disclosed
US-4897490-A DERIVATIVES OF BETA-HYDROXY,OMEGA-DIPHENYL,TETRAZOL-5-YL ALK-OMEGA-ENOIC ACID, ESTER OR LACTONE BRISTOL-MEYERS COMPANY (US) 1990-01-30 US disclosed
WO-1988006584-A1 ANTIHYPERCHOLESTEROLEMIC TETRAZOLE COMPOUNDS BRISTOL-MYERS COMPANY (US) 1988-09-07 WO disclosed