SCHEMBL11070754

SCHEMBL11070754

CCCCCCCCCCCCCCCC#CC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 5/20 0.39
HMGCR P04035 3/20 0.39
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
RECQL P46063 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
SPHK1 Q9NYA1 1/20 0.36
MMP2 P08253 1/20 0.35
MMP12 P39900 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
ALOX12 P18054 1/20 0.34
BLM P54132 1/20 0.34
MCL1 Q07820 1/20 0.34
NAAA Q02083 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
SCHEMBL11066474 1.00 PTPN7 (0.39) PTPN7HMGCRKMT2ASMN1; SMN2RECQL
SCHEMBL11064022 0.98 PTPN7 (0.37) PTPN7HMGCRKMT2ASMN1; SMN2RECQL
SCHEMBL11065426 0.94 KMT2A (0.33) PTPN7HMGCRKMT2ASMN1; SMN2SPHK1
SCHEMBL11064727 0.92 FAAH (0.43) PTPN7HMGCRKMT2ARECQLTDP1
SCHEMBL11063371 0.92 FAAH (0.43) PTPN7HMGCRKMT2ARECQLTDP1
SCHEMBL11070761 0.92 FAAH (0.43) PTPN7HMGCRKMT2ARECQLTDP1
SCHEMBL11064725 0.92 FAAH (0.43) PTPN7HMGCRKMT2ARECQLTDP1
SCHEMBL11064315 0.92 FAAH (0.43) PTPN7HMGCRKMT2ARECQLTDP1
SCHEMBL11063515 0.90 FAAH (0.43) PTPN7HMGCRKMT2ARECQLTDP1
SCHEMBL11068321 0.89 FAAH (0.49) PTPN7KMT2ARECQLTDP1KDM4E

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-4456619-A Amides of 2-alkynoic acids and use for inhibiting accumulation of cholesterol ester in arterial walls SANDOZ, INC. (US) 1984-06-26 US disclosed