SCHEMBL10588293

SCHEMBL10588293

O=[C][C@H](Cc1cccc2ccccc12)NC(=O)N1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.46
CYP3A4 P08684 1/20 0.44
CALCRL Q16602 1/20 0.44
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
CTNNB1 P35222 1/20 0.42
LMNA P02545 1/20 0.42
HRH4 Q9H3N8 1/20 0.41
MME P08473 1/20 0.41
ACE P12821 1/20 0.41
CPA1 P15085 1/20 0.41
ACE2 Q9BYF1 1/20 0.41
GFER P55789 1/20 0.40
MMP9 P14780 3/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 3/20 0.39
MMP8 P22894 2/20 0.39

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
SCHEMBL10588292 1.00 FAAH (0.46) FAAHCYP3A4CALCRLKMT2AMEN1
SCHEMBL9852728 0.90 KDM4E (0.53) FAAHKMT2AMEN1MMP9CTSS
SCHEMBL10587734 0.90 KDM4E (0.53) FAAHKMT2AMEN1MMP9CTSS
SCHEMBL8944896 0.79 TACR1 (0.51) KMT2AMEN1CTNNB1HRH4MME
SCHEMBL2269285 0.79 TACR1 (0.51) KMT2AMEN1CTNNB1HRH4MME
SCHEMBL9852735 0.76 ANPEP (0.49) KMT2AMEN1CTNNB1HRH4MME
SCHEMBL9631571 0.73 CTNNB1 (0.45) CTNNB1HRH4MMEACECPA1
SCHEMBL9727658 0.73 CTNNB1 (0.45) CTNNB1HRH4MMEACECPA1
SCHEMBL10305134 0.73 HRH2 (0.54) KMT2AMEN1CTNNB1LMNA
SCHEMBL10477667 0.72 CASP1 (0.54) CYP3A4HRH4CTSSCTSKALDH1A1

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
EP-0328089-A2 Reduced size LHRH analogs ABBOTT LABORATORIES (US) 1989-08-16 EP claimed