SCHEMBL13836644

SCHEMBL13836644

CC1c2[nH]c3ccccc3c2CCN1C(=S)NC(=O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.64
▸ MAPT P10636 2/20 0.62
▸ MEN1 O00255 1/20 0.62
▸ GAA P10253 1/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ ABCG2 Q9UNQ0 14/20 0.54
▸ ABCB1 P08183 10/20 0.54
▸ ALDH1A1 P00352 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ BCHE P06276 1/20 0.51
▸ ACHE P22303 1/20 0.51
▸ POLB P06746 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL28470333 0.81 LMNA (0.74) LMNAMAPTMEN1GAAKMT2A
SCHEMBL9401163 0.79 LMNA (0.70) LMNAMAPTMEN1GAAKMT2A
SCHEMBL17520528 0.79 LMNA (0.73) LMNAMAPTMEN1GAAKMT2A
SCHEMBL8372051 0.78 LMNA (0.69) LMNAMAPTMEN1GAAKMT2A
SCHEMBL11112953 0.78 MEN1 (0.64) LMNAMAPTMEN1GAAKMT2A
SCHEMBL9928821 0.78 PDE5A (0.63) ABCG2ABCB1
SCHEMBL9928823 0.78 PDE5A (0.63) ABCG2ABCB1
SCHEMBL29630338 0.75 LMNA (0.61) LMNAABCG2ABCB1ALDH1A1BCHE
SCHEMBL30196515 0.74 BCHE (0.78) LMNAMAPTMEN1GAAKMT2A
SCHEMBL17520529 0.73 LMNA (0.62) LMNAMAPTMEN1GAAKMT2A

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-20120295890-A1 GLYCOSAMINOGLYCAN INHIBITORS Zacharon Pharmaceutical, Inc. (US) 2012-11-22 — — 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-20120295890-A1 GLYCOSAMINOGLYCAN INHIBITORS CSGALNACT1, FUT5, ST3GAL3 LMNA 3422/4885MAPT 4328/4885MEN1 4634/4885

“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.

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