SCHEMBL1895478

SCHEMBL1895478

COc1cc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c(OC)cc1NC(=O)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.67
MEN1 O00255 5/20 0.67
HTT P42858 3/20 0.67
ALDH1A1 P00352 7/20 0.66
KDM4E B2RXH2 3/20 0.66
SMN1; SMN2 Q16637 5/20 0.65
LMNA P02545 4/20 0.64
MAPK1 P28482 2/20 0.62
L3MBTL1 Q9Y468 1/20 0.59
ALOX15 P16050 1/20 0.59
BDKRB1 P46663 1/20 0.58
MAPT P10636 3/20 0.58
HPGD P15428 1/20 0.58

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
SCHEMBL7150693 0.86 HTT (0.69) KMT2AMEN1HTTALDH1A1KDM4E
SCHEMBL6806837 0.78 ALDH1A1 (0.66) KMT2AMEN1HTTALDH1A1KDM4E
SCHEMBL23109708 0.78 LMNA (0.82) KMT2AMEN1HTTALDH1A1KDM4E
SCHEMBL27180963 0.77 SMN1; SMN2 (0.70) KMT2AMEN1HTTALDH1A1KDM4E
SCHEMBL30926988 0.77 SMN1; SMN2 (0.70) KMT2AMEN1HTTALDH1A1KDM4E
SCHEMBL7144948 0.77 ALDH1A1 (0.67) KMT2AMEN1HTTALDH1A1KDM4E
SCHEMBL8628044 0.77 SMN1; SMN2 (0.62) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL7153167 0.76 ALDH1A1 (0.67) KMT2AMEN1HTTALDH1A1KDM4E
SCHEMBL7150208 0.76 KMT2A (0.70) KMT2AMEN1HTTALDH1A1KDM4E
SCHEMBL7144933 0.76 ALDH1A1 (0.66) KMT2AMEN1HTTALDH1A1KDM4E

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
US-9504676-B2 Molecules inhibiting a metabolic pathway involving the Syk protein tyrosine kinase and method for identifying said molecules CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2016-11-29 US disclosed
US-20140179679-A1 MOLECULES INHIBITING A METABOLIC PATHWAY INVOLVING THE SYK PROTEIN TYROSINE KINASE AND METHOD FOR IDENTIFYING SAID MOLECULES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-06-26 US disclosed
US-20110112098-A1 MOLECULES INHIBITING A METABOLIC PATHWAY INVOLVING THE SYK PROTEIN TYROSINE KINASE AND METHOD FOR IDENTIFYING SAID MOLECULES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2011-05-12 US disclosed
US-20110112098-A1 MOLECULES INHIBITING A METABOLIC PATHWAY INVOLVING THE SYK PROTEIN TYROSINE KINASE AND METHOD FOR IDENTIFYING SAID MOLECULES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2011-05-12 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-20140179679-A1 MOLECULES INHIBITING A METABOLIC PATHWAY INVOLVING THE SYK PROTEIN TYROSINE KINASE AND METHOD FOR IDENTIFYING SAID MOLECULES SYK, BTK, TYRO3 KMT2A 1901/4885MEN1 4288/4885HTT 4431/4885
US-20110112098-A1 MOLECULES INHIBITING A METABOLIC PATHWAY INVOLVING THE SYK PROTEIN TYROSINE KINASE AND METHOD FOR IDENTIFYING SAID MOLECULES SYK, BTK, TYRO3 KMT2A 1901/4885MEN1 4288/4885HTT 4431/4885

“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.