SCHEMBL13082467

SCHEMBL13082467

O=C(O)N1CCc2cccc(F)c2C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.49
HTR5A P47898 3/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TRAP1 Q12931 3/20 0.46
DPP8 Q6V1X1 2/20 0.45
DPP9 Q86TI2 2/20 0.45
DPP7 Q9UHL4 2/20 0.45
HSP90B1 P14625 2/20 0.44
PDE4B Q07343 1/20 0.44
PDE4D Q08499 1/20 0.44
ABHD6 Q9BV23 1/20 0.44
DRD2 P14416 1/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NOTUM Q6P988 2/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.42
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL30924716 0.87 NPC1 (0.47) HTR5ANPC1RAB9ATRAP1DPP8
SCHEMBL27920628 0.86 HTR5A (0.53) RIPK1HTR5ANPC1RAB9APDE4B
SCHEMBL497487 0.85 TRAP1 (0.56) RIPK1NPC1RAB9ATRAP1DPP8
SCHEMBL30772456 0.85 TRAP1 (0.56) RIPK1NPC1RAB9ATRAP1DPP8
SCHEMBL30726807 0.82 ALDH1A1 (0.51) NPC1RAB9ATRAP1ABHD6DRD2
SCHEMBL16269409 0.82 DRD1 (0.47) HTR5ANPC1RAB9AABHD6DRD2
SCHEMBL28182441 0.82 HPGD (0.44) HTR5ANPC1RAB9AABHD6ALDH1A1
SCHEMBL27920632 0.81 GAA (0.49) HTR5APDE4BPDE4DALDH1A1HPGD
SCHEMBL20564523 0.81 ABHD6 (0.60) HTR5ANPC1RAB9ATRAP1ABHD6
SCHEMBL29118091 0.81 NOTUM (0.42) HTR5ANPC1RAB9AABHD6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7829665-B2 Macrocyclic inhibitors of hepatitis C virus replication INTERMUNE, INC. (US) 2010-11-09 US disclosed
US-20070054842-A1 Novel macrocyclic inhibitors of hepatitis C virus replication ARRAY BIOPHARMA, INC. 2007-03-08 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-20070054842-A1 Novel macrocyclic inhibitors of hepatitis C virus replication EIF2AK2, HAVCR2, HCCS RIPK1 2134/4885HTR5A 4806/4885NPC1 254/4885

“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.