SCHEMBL15840667

SCHEMBL15840667

COc1ccc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)CC(C)C)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 1.00
ALOX12 P18054 5/20 1.00
KMT2A Q03164 5/20 1.00
MEN1 O00255 4/20 1.00
MAPT P10636 3/20 1.00
HTT P42858 2/20 1.00
NPSR1 Q6W5P4 4/20 0.80
TAAR1 Q96RJ0 1/20 0.74
POLB P06746 2/20 0.67
LMNA P02545 3/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
PPIA P62937 1/20 0.63
GAA P10253 2/20 0.61
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59

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
SCHEMBL15840622 0.89 ALDH1A1 (1.00) ALDH1A1ALOX12KMT2AMEN1MAPT
SCHEMBL15840656 0.87 ALDH1A1 (0.78) ALDH1A1ALOX12KMT2AMEN1MAPT
SCHEMBL15840611 0.85 ALDH1A1 (1.00) ALDH1A1ALOX12KMT2AMEN1MAPT
SCHEMBL15840652 0.83 NPSR1 (0.74) ALDH1A1ALOX12KMT2AMEN1MAPT
SCHEMBL15840804 0.83 ALDH1A1 (0.75) ALDH1A1ALOX12KMT2AMEN1MAPT
SCHEMBL15840615 0.82 NPSR1 (0.73) ALDH1A1ALOX12KMT2AMEN1MAPT
SCHEMBL13470114 0.81 ALDH1A1 (0.76) ALDH1A1ALOX12KMT2AMEN1MAPT
SCHEMBL17066602 0.81 ALDH1A1 (0.68) ALDH1A1ALOX12KMT2AMEN1MAPT
SCHEMBL17066610 0.81 ALDH1A1 (0.68) ALDH1A1ALOX12KMT2AMEN1MAPT
SCHEMBL13470086 0.80 ALDH1A1 (0.66) ALDH1A1ALOX12KMT2AMEN1MAPT

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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2014-06-26 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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT EGFR, ERBB2, ERBB3 ALDH1A1 4348/4885ALOX12 3344/4885KMT2A 3667/4885

“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.