SCHEMBL12422175

SCHEMBL12422175

COc1cc(-c2nc3ccc(C)cc3s2)ccc1N

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 8/20 0.64
MAPT P10636 7/20 0.64
RAB9A P51151 3/20 0.64
KDM4E B2RXH2 3/20 0.64
GLA P06280 2/20 0.64
GAA P10253 2/20 0.64
NPC1 O15118 2/20 0.64
SNCA P37840 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 3/20 0.51
HPGD P15428 2/20 0.51
PPARG P37231 1/20 0.51
NCOA2 Q15596 1/20 0.51
NCOA1 Q15788 1/20 0.51
TP53 P04637 3/20 0.50
HSD17B10 Q99714 2/20 0.49
CYP3A4 P08684 1/20 0.49
TSHR P16473 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CCNE1 P24864 1/20 0.48

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
SCHEMBL1987724 0.87 APP (0.72) APPGLAGAASNCACYP3A4
SCHEMBL4602210 0.84 KDM4E (0.71) APPMAPTRAB9AKDM4EGLA
SCHEMBL10311766 0.81 APP (0.68) APPMAPTRAB9AKDM4EGLA
SCHEMBL7109596 0.81 APP (0.68) APPMAPTRAB9AKDM4EGLA
SCHEMBL7104765 0.81 APP (0.71) APPMAPTRAB9AKDM4EGLA
SCHEMBL8393669 0.81 MAPT (0.53) APPMAPTRAB9AKDM4EGLA
SCHEMBL12422176 0.79 MAPT (0.51) APPMAPTRAB9AKDM4EGLA
SCHEMBL2628249 0.79 APP (0.94) APPMAPTRAB9AKDM4EGLA
SCHEMBL4848589 0.79 MAPT (0.76) APPMAPTRAB9AKDM4EGLA
SCHEMBL492713 0.79 APP (1.00) APPMAPTRAB9AKDM4EGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895313-B2 Ligands for aggregated tau molecules WISTA LABORATORIES LTD. (SG) 2014-11-25 US disclosed
US-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. 2011-07-14 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 (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-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES MAPT, PRNP, MAP4 APP 17/4885MAPT 1/4885RAB9A 2622/4885

“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.