SCHEMBL1069178

SCHEMBL1069178

NC(=O)n1cnc2[c]cccc21

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.36
ELANE P08246 1/20 0.33
KMT2A Q03164 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
ASAH1 Q13510 3/20 0.31
HTT P42858 1/20 0.31
FGFR1 P11362 1/20 0.31
MEN1 O00255 1/20 0.31
DNMT3A Q9Y6K1 1/20 0.30

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
SCHEMBL828619 0.73 KMT2A (0.57) KMT2ASMN1; SMN2ASAH1HTTMEN1
SCHEMBL11882632 0.73 KMT2A (0.57) KMT2ASMN1; SMN2ASAH1HTTMEN1
SCHEMBL6598982 0.72
SCHEMBL7611308 0.71 KMT2A (0.55) KMT2ASMN1; SMN2ASAH1HTTMEN1
Hydrochloric Acid SCHEMBL738023 0.71 KMT2A (0.55) KMT2ASMN1; SMN2ASAH1HTTMEN1
Bromide SCHEMBL7400039 0.71 KMT2A (0.55) KMT2ASMN1; SMN2ASAH1HTTMEN1
SCHEMBL5571659 0.70 PARP1 (0.47) PARP1KMT2AASAH1MEN1
Carbamic Acid SCHEMBL10888970 0.70 SMN1; SMN2 (0.56) KMT2ASMN1; SMN2ASAH1HTTMEN1
SCHEMBL1823973 0.68 GRM5 (0.34) SMN1; SMN2HTT
SCHEMBL6526827 0.68 KMT2A (0.35) PARP1KMT2ASMN1; SMN2ASAH1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160045617-A1 TREATMENT OF PROXIMAL SPINAL MUSCULAR ATROPHY LEE JUSTIN C (US) 2016-02-18 US claimed
WO-2014169087-A2 TREATMENT OF PROXIMAL SPINAL MUSCULAR ATROPHY THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2014-10-16 WO claimed
US-20160045617-A1 TREATMENT OF PROXIMAL SPINAL MUSCULAR ATROPHY LEE JUSTIN C (US) 2016-02-18 US disclosed
WO-2014169087-A2 TREATMENT OF PROXIMAL SPINAL MUSCULAR ATROPHY THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2014-10-16 WO disclosed
US-20110039895-A1 PROLYL HYDROXYLASE INHIBITORS Glaxo Smith Kline LLC., a corporation 2011-02-17 US disclosed
US-20110039895-A1 PROLYL HYDROXYLASE INHIBITORS Glaxo Smith Kline LLC., a corporation 2011-02-17 US disclosed
EP-2273879-A1 PROLYL HYDROXYLASE INHIBITORS GlaxoSmithKline LLC (US) 2011-01-19 EP disclosed
EP-2273879-A1 PROLYL HYDROXYLASE INHIBITORS GlaxoSmithKline LLC (US) 2011-01-19 EP disclosed
WO-2009134850-A1 PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-11-05 WO disclosed
WO-2009134850-A1 PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-11-05 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-20110039895-A1 PROLYL HYDROXYLASE INHIBITORS HIF1AN, EGLN3, EGLN2 PARP1 1606/4885ELANE 2819/4885KMT2A 292/4885
US-20160045617-A1 TREATMENT OF PROXIMAL SPINAL MUSCULAR ATROPHY CELF2, SMN1; SMN2, GRM8 PARP1 4392/4885ELANE 1423/4885KMT2A 2131/4885

“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.