SCHEMBL14768668

SCHEMBL14768668

Cc1ccc2nc(-c3ccc4nc(-c5ccc6nc(-c7ccc8nc(-c9ccc(N)cc9)sc8c7)sc6c5)sc4c3)sc2c1S(=O)(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.86
GLA P06280 5/20 0.86
ALDH1A1 P00352 5/20 0.86
HPGD P15428 5/20 0.86
SMN1; SMN2 Q16637 5/20 0.86
HSD17B10 Q99714 3/20 0.86
TP53 P04637 3/20 0.86
RECQL P46063 2/20 0.86
TDP1 Q9NUW8 2/20 0.86
CASP1 P29466 2/20 0.86
CASP7 P55210 2/20 0.86
CYP3A4 P08684 1/20 0.86
NT5E P21589 1/20 0.86
APP P05067 10/20 0.56
MAPT P10636 7/20 0.56
KDM4E B2RXH2 5/20 0.56
NPC1 O15118 4/20 0.56
RAB9A P51151 4/20 0.56
POLB P06746 2/20 0.53
MITF O75030 1/20 0.53

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
SCHEMBL5578358 1.00 GAA (0.86) GAAGLAALDH1A1HPGDSMN1; SMN2
SCHEMBL15940004 1.00 GAA (0.86) GAAGLAALDH1A1HPGDSMN1; SMN2
SCHEMBL10605029 1.00 GAA (0.86) GAAGLAALDH1A1HPGDSMN1; SMN2
SCHEMBL15093377 0.99 GAA (0.84) GAAGLAALDH1A1HPGDSMN1; SMN2
SCHEMBL633557 0.93 GAA (1.00) GAAGLAALDH1A1HPGDSMN1; SMN2
Nitrogen SCHEMBL28754258 0.91 GAA (0.95) GAAGLAALDH1A1HPGDSMN1; SMN2
SCHEMBL95545 0.89 GAA (0.68) GAAGLAALDH1A1HPGDSMN1; SMN2
SCHEMBL14768727 0.89 ALDH1A1 (0.68) GAAGLAALDH1A1HPGDSMN1; SMN2
SCHEMBL14768698 0.88 ALDH1A1 (0.67) GAAGLAALDH1A1HPGDSMN1; SMN2
SCHEMBL15939945 0.87 GAA (0.88) GAAGLAALDH1A1HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464064-B2 HCV helicase inhibitors and methods of use thereof UNIVERSITY OF KANSAS (US) 2016-10-11 US disclosed
US-9464064-B2 HCV helicase inhibitors and methods of use thereof UNIVERSITY OF KANSAS (US) 2016-10-11 US disclosed
US-20140227225-A1 HCV Helicase Inhibitors and Methods of Use Thereof UWM RESEARCH FOUNDATION, INC. (US) 2014-08-14 US disclosed
US-20140227225-A1 HCV Helicase Inhibitors and Methods of Use Thereof UWM RESEARCH FOUNDATION, INC. (US) 2014-08-14 US disclosed
WO-2013036749-A1 HCV HELICASE INHIBITORS AND METHODS OF USE THEREOF UNIVERSITY OF KANSAS (US) 2013-03-14 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 (1 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-20140227225-A1 HCV Helicase Inhibitors and Methods of Use Thereof DHX15, DDX5, DHX35 GAA 999/4885GLA 3617/4885ALDH1A1 1138/4885

“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.