SCHEMBL3466404

SCHEMBL3466404

NC(=O)c1ccc(S(=O)(=O)N2CCOCC2)nc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KMT2A Q03164 4/20 0.45
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 4/20 0.44
ALPL P05186 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
PLAU P00749 1/20 0.42
POLB P06746 2/20 0.42
NNMT P40261 1/20 0.41

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
SCHEMBL2744785 0.78 L3MBTL1 (0.70) MAPK1L3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL26983350 0.78 LMNA (0.52) L3MBTL1KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL15759044 0.77 KMT2A (0.55) MAPK1L3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL3466407 0.76 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2TDP1POLB
SCHEMBL357927 0.74 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2POLB
SCHEMBL29467280 0.73 HSD11B1 (0.47) MAPK1L3MBTL1KMT2AMEN1ALDH1A1
Hydrochloric Acid SCHEMBL5013604 0.72 ALDH1A1 (0.69) ALDH1A1SMN1; SMN2POLB
SCHEMBL3121516 0.72 HDAC3 (0.41) KMT2AMEN1ALDH1A1SMN1; SMN2NNMT
SCHEMBL18537752 0.72 CA2 (0.55) L3MBTL1SMN1; SMN2NNMT
SCHEMBL3126246 0.72 NNMT (0.47) L3MBTL1SMN1; SMN2NNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2346868-B1 AZAINDAZOLE COMPOUNDS AS CCR1 RECEPTOR ANTAGONISTS BOEHRINGER INGELHEIM INT (DE) 2016-01-27 EP disclosed
US-8338610-B2 Pyridinyl compounds useful as intermediates BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-12-25 US disclosed
US-20120136158-A1 Pyridinyl Compounds Useful As Intermediates BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-31 US disclosed
US-20100093724-A1 Azaindazole Compounds As CCR1 Receptor Antagonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 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 (2 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-20100093724-A1 Azaindazole Compounds As CCR1 Receptor Antagonists CCR1, CCR3, CCR4 MAPK1 973/4885L3MBTL1 4281/4885KMT2A 2845/4885
US-20120136158-A1 Pyridinyl Compounds Useful As Intermediates CCR1, CCRL2, CCR4 MAPK1 410/4885L3MBTL1 4336/4885KMT2A 4793/4885

“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.