SCHEMBL4428019

SCHEMBL4428019

CCc1ccc(NC(=O)c2ccccc2OC)cc1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.71
SMN1; SMN2 Q16637 6/20 0.71
RAB9A P51151 5/20 0.71
NPC1 O15118 4/20 0.71
MAPK1 P28482 4/20 0.71
TP53 P04637 3/20 0.71
KMT2A Q03164 2/20 0.70
ALDH1A1 P00352 4/20 0.68
KCNK3 O14649 2/20 0.64
KCNK9 Q9NPC2 2/20 0.64
KLKB1 P03952 1/20 0.63
RXFP1 Q9HBX9 1/20 0.60
KDM4E B2RXH2 1/20 0.59
LMNA P02545 1/20 0.59
AHR P35869 1/20 0.59
GFER P55789 1/20 0.59
GAA P10253 1/20 0.58
TSHR P16473 1/20 0.58
HSD17B10 Q99714 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
SCHEMBL14062901 0.89 MAPT (0.67) MAPTSMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL28133927 0.88 MAPT (0.70) MAPTSMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL14096572 0.87 MAPT (0.68) MAPTSMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL2060705 0.86 NR1H4 (0.73) MAPTSMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL2721612 0.84 MAPT (0.73) MAPTSMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL2362772 0.84 KMT2A (0.82) MAPTSMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL13310256 0.84 MAPT (0.62) MAPTSMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL9645453 0.83 ALDH1A1 (0.81) MAPTSMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL14435720 0.83 MAPT (0.64) MAPTSMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL4347151 0.83 MAPT (0.64) MAPTSMN1; SMN2RAB9ANPC1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9447027-B2 Treating long QT syndrome THE GENERAL HOSPITAL CORPORATION (US) 2016-09-20 US disclosed
US-9447027-B2 Treating long QT syndrome THE GENERAL HOSPITAL CORPORATION (US) 2016-09-20 US disclosed
US-20130310351-A1 Treating Long QT Syndrome THE GENERAL HOSPITAL CORPORATION (US) 2013-11-21 US disclosed
WO-2012054718-A2 TREATING LONG QT SYNDROME THE GENERAL HOSPITAL CORPORATION (US) 2012-04-26 WO disclosed
US-7727558-B2 Polymeric delivery agents and delivery agent compounds EMISPHERE TECHNOLOGIES, INC. (US) 2010-06-01 US disclosed
US-20070141022-A1 POLYMERIC DELIVERY AGENTS AND DELIVERY AGENT COMPOUNDS EMISPHERE TECHNOLOGIES, INC. 2007-06-21 US disclosed
US-7208483-B2 Polymeric delivery agents and delivery agent compounds EMISPHERE TECHNOLOGIES, INC. (US) 2007-04-24 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-20130310351-A1 Treating Long QT Syndrome TNNI3, TNNT2, TNNC1 MAPT 3780/4885SMN1; SMN2 546/4885RAB9A 1007/4885
US-20070141022-A1 POLYMERIC DELIVERY AGENTS AND DELIVERY AGENT COMPOUNDS LPXN, PGF, TTPA MAPT 853/4885SMN1; SMN2 1040/4885RAB9A 2693/4885

“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.