SCHEMBL9798987

SCHEMBL9798987

COCCOCOn1nnnc1C(C=O)=C(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.38
USP2 O75604 1/20 0.38
HMGCR P04035 1/20 0.37
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
GAA P10253 1/20 0.31
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HTR7 P34969 1/20 0.30

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
SCHEMBL9726787 0.83 HSD17B10 (0.43) HSD17B10USP2HMGCRKDM4EALDH1A1
SCHEMBL9726603 0.74 HSD17B10 (0.38) HSD17B10USP2KDM4EALDH1A1HPGD
SCHEMBL9726839 0.73 HSD17B10 (0.41) HSD17B10USP2HMGCRKDM4EALDH1A1
SCHEMBL9726834 0.73 HSD17B10 (0.41) HSD17B10USP2HMGCRKDM4EALDH1A1
SCHEMBL9726533 0.73 HMGCR (0.55) HSD17B10USP2HMGCRALDH1A1
SCHEMBL9726806 0.73 HMGCR (0.43) HSD17B10USP2HMGCRALDH1A1HPGD
SCHEMBL9726484 0.71 HMGCR (0.43) HMGCRHPGD
SCHEMBL9726705 0.69 HMGCR (0.52) HMGCRALDH1A1GAA
SCHEMBL9726690 0.69 HMGCR (0.52) HMGCRALDH1A1GAA
SCHEMBL9726697 0.69 HMGCR (0.52) HMGCRALDH1A1GAA

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-5068346-A Anticholesterol agents BRISTOL-MYERS COMPANY (US) 1991-11-26 US disclosed