SCHEMBL6367462

SCHEMBL6367462

C=Cc1nc(-c2ccc(F)cc2)no1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 3/20 0.60
SENP8 Q96LD8 3/20 0.60
SENP7 Q9BQF6 3/20 0.60
SENP6 Q9GZR1 2/20 0.56
NPC1 O15118 7/20 0.47
RAB9A P51151 7/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
HTT P42858 1/20 0.47
SIRT2 Q8IXJ6 1/20 0.46
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 4/20 0.42
TP53 P04637 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
HDAC1 Q13547 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
HDAC8 Q9BY41 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL2360965 0.76 NPC1 (0.51) CASP3SENP8SENP7SENP6NPC1
SCHEMBL28008657 0.73 CASP3 (0.55) CASP3SENP8SENP7SENP6NPC1
SCHEMBL6367494 0.73 NPC1 (0.53) CASP3SENP8SENP7SENP6NPC1
SCHEMBL24061386 0.72 NOTUM (0.66) CASP3SENP8SENP7SENP6NPC1
SCHEMBL2360966 0.72 L3MBTL1 (0.58) CASP3SENP8SENP7SENP6NPC1
SCHEMBL30817763 0.70 CASP3 (0.45) CASP3SENP8SENP7SENP6NPC1
SCHEMBL29176860 0.70 CASP3 (0.45) CASP3SENP8SENP7SENP6NPC1
SCHEMBL21988604 0.70 CASP3 (0.53) CASP3SENP8SENP7SENP6NPC1
SCHEMBL21988603 0.70 CASP3 (0.53) CASP3SENP8SENP7SENP6NPC1
SCHEMBL16217987 0.69 HDAC6 (0.69) HDAC1HDAC6HDAC8HDAC4

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-20050043545-A1 4-(5-Membered)-heteroaryl acyl pyrrolidine derivatives as hcv inhibitors GLAXO GROUP LIMITED (GB) 2005-02-24 US disclosed
EP-1440070-A1 4-(5-MEMBERED)-HETEROARYL ACYL PYRROLIDINE DERIVATIVES AS HCV INHIBITORS GLAXO GROUP LIMITED (GB) 2004-07-28 EP disclosed
WO-2003037894-A1 4-(5-MEMBERED)-HETEROARYL ACYL PYRROLIDINE DERIVATIVES AS HCV INHIBITORS GLAXO GROUP LIMITED (GB) 2003-05-08 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-20050043545-A1 4-(5-Membered)-heteroaryl acyl pyrrolidine derivatives as hcv inhibitors NR1H3, NR1H2, NR1I3 CASP3 3895/4885SENP8 4250/4885SENP7 4047/4885

“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.