SCHEMBL5518804

SCHEMBL5518804

COC(=O)c1cc2c(CN3CCC(O)(CN4CCCC4=O)CC3)cn(Cc3ccc(F)cc3F)c2cn1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 8/20 0.47
BDKRB1 P46663 1/20 0.40
SLC6A2 P23975 1/20 0.35
SLC6A3 Q01959 1/20 0.35
FSCN1 Q16658 1/20 0.35
CFTR P13569 3/20 0.34
GPR6 P46095 1/20 0.34
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
ACHE P22303 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
SCHEMBL5253860 0.93 USP7 (0.43) USP7BDKRB1SLC6A2SLC6A3FSCN1
SCHEMBL5534369 0.91 USP7 (0.40) USP7SLC6A2SLC6A3FSCN1CFTR
SCHEMBL5526756 0.91 USP7 (0.40) USP7SLC6A2SLC6A3FSCN1GPR6
SCHEMBL5254813 0.90 USP7 (0.39) USP7SLC6A2SLC6A3FSCN1GPR6
SCHEMBL5524576 0.90 USP7 (0.40) USP7BDKRB1SLC6A2SLC6A3FSCN1
SCHEMBL5255268 0.88 USP7 (0.40) USP7SLC6A2SLC6A3FSCN1GPR6
SCHEMBL5255828 0.88 USP7 (0.39) USP7BDKRB1SLC6A2SLC6A3FSCN1
SCHEMBL5524697 0.87 USP7 (0.38) USP7SLC6A2SLC6A3FSCN1GPR6
SCHEMBL5253315 0.87 USP7 (0.38) USP7SLC6A2SLC6A3FSCN1ALDH1A1
SCHEMBL5257545 0.86 USP7 (0.37) USP7BDKRB1SLC6A2SLC6A3FSCN1

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-20070232644-A1 1-(2,4-difluorobenzyl)-N-hydroxy-3-{[3-(methylsulfonyl)pyrrolidin-1-yl]methyl}-1H-pyrrolo[2,3-c]pyridine-5-carboxamide;acquired immunodeficiency syndrome (\"AIDS\"), and AIDS related complex (\"ARC\") PFIZER INC. 2007-10-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070232644-A1 1-(2,4-difluorobenzyl)-N-hydroxy-3-{[3-(methylsulfonyl)pyrrolidin-1-yl]methyl}-1H-pyrrolo[2,3-c]pyridine-5-carboxamide;acquired immunodeficiency syndrome (\"AIDS\"), and AIDS related complex (\"ARC\") AP1M1, AP1G1, AP3B1 USP7 4732/4885BDKRB1 2572/4885SLC6A2 3268/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.