SCHEMBL4283740

SCHEMBL4283740

Cc1noc(-c2ccccc2)c1C(=O)N1CCNCC1Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
CA4 P22748 2/20 0.51
CA9 Q16790 2/20 0.51
REN P00797 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.46
SCD5 Q86SK9 1/20 0.45
HCRTR1 O43613 2/20 0.43
HCRTR2 O43614 2/20 0.43
CYP3A4 P08684 1/20 0.43
DPP4 P27487 4/20 0.43
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
DPP7 Q9UHL4 2/20 0.42
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMYD3 Q9H7B4 1/20 0.40
ALDH1A1 P00352 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL4283737 1.00 CA1 (0.51) CA1CA2CA4CA9REN
SCHEMBL4278308 0.78 CA1 (0.53) CA1CA2CA4CA9REN
SCHEMBL4278318 0.78 CA1 (0.53) CA1CA2CA4CA9REN
SCHEMBL3545920 0.77 SCD5 (0.53) SMN1; SMN2SCD5HCRTR1HCRTR2LMNA
SCHEMBL4281205 0.74 CA1 (0.58) CA1CA2CA4CA9REN
SCHEMBL4281201 0.74 CA1 (0.58) CA1CA2CA4CA9REN
SCHEMBL8480340 0.74 CA1 (0.64) CA1CA2CA4CA9REN
SCHEMBL590923 0.74 CA1 (0.62) CA1CA2CA4CA9REN
SCHEMBL28045116 0.74 CA1 (0.62) CA1CA2CA4CA9REN
SCHEMBL3494609 0.73 REN (0.54) CA1CA2CA4CA9REN

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-20090105251-A1 Renin inhibitors TAKEDA SAN DIEGO, INC. 2009-04-23 US claimed
US-20090105251-A1 Renin inhibitors TAKEDA SAN DIEGO, INC. 2009-04-23 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-20090105251-A1 Renin inhibitors REN, ACE, AGT CA1 1185/4885CA2 275/4885CA4 379/4885

“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.