SCHEMBL5524697

SCHEMBL5524697

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

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 10/20 0.38
GPR6 P46095 2/20 0.35
SLC6A2 P23975 1/20 0.32
SLC6A3 Q01959 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
FSCN1 Q16658 1/20 0.32
GRIN2B Q13224 1/20 0.31
KDM4E B2RXH2 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL5255268 0.95 USP7 (0.40) USP7GPR6SLC6A2SLC6A3ALDH1A1
SCHEMBL5530235 0.93 USP7 (0.36) USP7GPR6SLC6A2SLC6A3FSCN1
SCHEMBL5254813 0.93 USP7 (0.39) USP7GPR6SLC6A2SLC6A3ALDH1A1
SCHEMBL5255956 0.90 USP7 (0.36) USP7GPR6SLC6A2SLC6A3FSCN1
SCHEMBL5534369 0.88 USP7 (0.40) USP7GPR6SLC6A2SLC6A3ALDH1A1
SCHEMBL5518804 0.87 USP7 (0.47) USP7GPR6SLC6A2SLC6A3ALDH1A1
SCHEMBL5526756 0.86 USP7 (0.40) USP7GPR6SLC6A2SLC6A3FSCN1
SCHEMBL5253860 0.86 USP7 (0.43) USP7GPR6SLC6A2SLC6A3ALDH1A1
SCHEMBL14376131 0.85 USP7 (0.34) USP7GPR6ALDH1A1TDP1GRIN2B
SCHEMBL5524576 0.85 USP7 (0.40) USP7GPR6SLC6A2SLC6A3ALDH1A1

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
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 claimed
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
WO-2006027694-A1 INHIBITORS OF THE HIV INTEGRASE ENZYME PFIZER INC. (US) 2006-03-16 WO 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 4732/4885GPR6 2058/4885SLC6A2 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.