SCHEMBL4697923

SCHEMBL4697923

CCCCCCCCC(C#N)CC(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.46
MEN1 O00255 1/20 0.43
HPGD P15428 1/20 0.43
RECQL P46063 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
BIRC2 Q13490 1/20 0.42
GPR84 Q9NQS5 7/20 0.41
POLB P06746 1/20 0.40
POLA1 P09884 1/20 0.40
FAAH O00519 4/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
FFAR1 O14842 1/20 0.39
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL17759227 0.87 TSHR (0.34) ZDHHC7MEN1HPGDRECQLKMT2A
SCHEMBL8745342 0.85 ZDHHC7 (0.41) ZDHHC7MEN1KMT2AGPR84FAAH
SCHEMBL5979352 0.81 L3MBTL1 (0.48) ZDHHC7LMNAPOLBPOLA1CA12
SCHEMBL28288468 0.80 GPR84 (0.58) MEN1KMT2AHSD17B10GPR84FFAR1
SCHEMBL3252079 0.80 GPR84 (0.44) GPR84FFAR1CA2MAPT
SCHEMBL27392936 0.80 TSHR (0.37) HPGDHSD17B10CA2MAPT
SCHEMBL23130113 0.79 ZDHHC7 (0.42) ZDHHC7MEN1HPGDRECQLKMT2A
SCHEMBL3130310 0.79 GPR84 (0.43) GPR84FFAR1CA2MAPT
SCHEMBL3122476 0.79 GPR84 (0.43) GPR84FFAR1CA2MAPT
SCHEMBL5074118 0.78 ZDHHC7 (0.52) ZDHHC7MEN1HPGDRECQLKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1853608-B1 5-ALKOXYALKYL-6-ALKYL-7-AMINO-AZOLOPYRIMIDINES, METHOD FOR THEIR PRODUCTION, THEIR USE FOR CONTROLLING PATHOGENIC FUNGI AND AGENTS CONTAINING SAID SUBSTANCES BASF SE (DE) 2008-07-09 EP disclosed
EP-1853608-A1 5-ALKOXYALKYL-6-ALKYL-7-AMINO-AZOLOPYRIMIDINES, METHOD FOR THEIR PRODUCTION, THEIR USE FOR CONTROLLING PATHOGENIC FUNGI AND AGENTS CONTAINING SAID SUBSTANCES BASF AKTIENGESELLSCHAFT (DE) 2007-11-14 EP disclosed
WO-2006087325-A1 5-ALKOXYALKYL-6-ALKYL-7-AMINO-AZOLOPYRIMIDINES, METHOD FOR THEIR PRODUCTION, THEIR USE FOR CONTROLLING PATHOGENIC FUNGI AND AGENTS CONTAINING SAID SUBSTANCES BASF AKTIENGESELLSCHAFT (DE) 2006-08-24 WO disclosed