SCHEMBL1478152

SCHEMBL1478152

COc1cccc2onc(NC[C@H](C)c3ccccc3)c12

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 5/20 0.61
SGMS2 Q8NHU3 2/20 0.43
SGMS1 Q86VZ5 1/20 0.43
BCHE P06276 1/20 0.41
KAT6A Q92794 8/20 0.40
KAT7 O95251 7/20 0.40
KAT6B Q8WYB5 4/20 0.40
KMT2A Q03164 1/20 0.40
KAT5 Q92993 1/20 0.37
KAT8 Q9H7Z6 1/20 0.37

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
SCHEMBL1478104 1.00 KCNA5 (0.61) KCNA5SGMS2SGMS1BCHEKAT6A
SCHEMBL1478103 1.00 KCNA5 (0.61) KCNA5SGMS2SGMS1BCHEKAT6A
SCHEMBL2628028 0.90 KCNA5 (0.52) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL2633191 0.84 KCNA5 (0.56) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL2628031 0.82 KCNA5 (0.54) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL2628030 0.80 KCNA5 (0.52) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL2628029 0.79 KCNA5 (0.51) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL1478346 0.76 KCNA5 (0.47) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL1478328 0.76 KCNA5 (0.48) KCNA5SGMS2SGMS1KAT6AKAT7
SCHEMBL1478871 0.76 KCNA5 (1.00) KCNA5SGMS2SGMS1KAT6AKAT7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8357809-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-22 US disclosed
US-8357809-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-22 US disclosed
US-8357809-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-22 US disclosed
US-20120094983-A1 ACYCLIC IKUR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-04-19 US disclosed
US-20120094983-A1 ACYCLIC IKUR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-04-19 US disclosed
US-20120094983-A1 ACYCLIC IKUR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-04-19 US disclosed
US-7915410-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-29 US disclosed
US-7915410-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-29 US disclosed
US-7915410-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-29 US disclosed
EP-1922311-A2 ACYCLIC IKUR INHIBITORS Brystol-Myers Squibb Company (US) 2008-05-21 EP disclosed
US-20070082909-A1 Acyclic Ikur inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-12 US disclosed
US-20070082909-A1 Acyclic Ikur inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-12 US disclosed
US-20070082909-A1 Acyclic Ikur inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-12 US disclosed
WO-2007030582-A2 ACYCLIC IKUR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-03-15 WO disclosed
WO-2007030582-A2 ACYCLIC IKUR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-03-15 WO 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-20070082909-A1 Acyclic Ikur inhibitors KCNH2, KCNJ2, KCNH3 KCNA5 67/4885SGMS2 3812/4885SGMS1 3050/4885
US-20120094983-A1 ACYCLIC IKUR INHIBITORS KCNH2, KCNJ2, KCNH3 KCNA5 67/4885SGMS2 3812/4885SGMS1 3050/4885

“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.