SCHEMBL13812295

SCHEMBL13812295

CC(C)C(=O)NS(=O)(=O)N(C)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
NPSR1 Q6W5P4 1/20 0.36
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HPGD P15428 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
ERCC1 P07992 1/20 0.31
ERCC4 Q92889 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL9911480 0.84 CA1 (0.44) ALDH1A1NPSR1CA1CA2SMN1; SMN2
SCHEMBL13773158 0.79 MMP1 (0.36) ALDH1A1NPSR1CA1CA2CA12
SCHEMBL24961528 0.79 CA1 (0.33) ALDH1A1CA1CA2SMN1; SMN2HPGD
SCHEMBL25121305 0.77 CA1 (0.32) ALDH1A1CA1CA2HPGD
SCHEMBL13799203 0.74 GAA (0.33) ALDH1A1CA1CA2HPGDCA12
SCHEMBL13764329 0.74 ALDH1A1 (0.32) ALDH1A1
SCHEMBL85557 0.74 NPSR1 (0.35) ALDH1A1NPSR1SMN1; SMN2LMNA
SCHEMBL84997 0.72 LMNA (0.40) ALDH1A1NPSR1SMN1; SMN2HPGDLMNA
SCHEMBL6697856 0.71 ALDH1A1 (0.41) ALDH1A1NPSR1CA1CA2SMN1; SMN2
SCHEMBL4070679 0.70 NPSR1 (0.48) ALDH1A1NPSR1CA1CA2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156553-A1 PIPERAZINE COMPOUNDS WITH A HERBICIDAL ACTION BASF SE (DE) 2009-06-18 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-20090156553-A1 PIPERAZINE COMPOUNDS WITH A HERBICIDAL ACTION DDT, CAT, CIP2A ALDH1A1 77/4885NPSR1 1061/4885CA1 1695/4885

“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.