SCHEMBL2808107

SCHEMBL2808107

CCCCC(C(N)=O)S(=O)(=O)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.48
CA1 P00915 4/20 0.48
TP53 P04637 1/20 0.42
EPHX1 P07099 1/20 0.39
SLC15A1 P46059 1/20 0.38
MAPK1 P28482 1/20 0.36
SPHK1 Q9NYA1 1/20 0.35
SLC1A3 P43003 1/20 0.35
SLC1A2 P43004 1/20 0.35
SLC1A1 P43005 1/20 0.35
DPP7 Q9UHL4 2/20 0.35
DPP8 Q6V1X1 1/20 0.35
RECQL P46063 1/20 0.34
MMP9 P14780 1/20 0.34
MMP13 P45452 1/20 0.34

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
SCHEMBL2807679 0.82 CA2 (0.50) CA2CA1TP53EPHX1SLC15A1
SCHEMBL27697229 0.82 CA2 (0.50) CA2CA1TP53EPHX1SLC15A1
SCHEMBL2810383 0.82 CA2 (0.50) CA2CA1TP53EPHX1SLC15A1
SCHEMBL15110520 0.76 TP53 (0.47) CA2CA1TP53EPHX1SLC1A2
SCHEMBL29211666 0.74 TP53 (0.46) CA2CA1TP53EPHX1
SCHEMBL4814530 0.74 TP53 (0.50) CA2CA1TP53EPHX1RECQL
SCHEMBL11310381 0.74 TP53 (0.50) CA2CA1TP53EPHX1RECQL
SCHEMBL6240268 0.74 TP53 (0.50) CA2CA1TP53EPHX1RECQL
SCHEMBL31008464 0.72 CA2 (0.50) CA2CA1TP53MAPK1SLC1A3
SCHEMBL7316786 0.72 CA2 (0.54) CA2CA1TP53EPHX1SLC15A1

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-9150556-B2 Benzimidazolone chymase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-06 US disclosed
US-20100240702-A1 Benzimidazolone Chymase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-23 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-20100240702-A1 Benzimidazolone Chymase Inhibitors CMA1, SERPINB1, CPA3 CA2 743/4885CA1 3632/4885TP53 2181/4885

“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.