SCHEMBL2196579

SCHEMBL2196579

COc1ccc2nc(-c3ccc(NC(=O)c4ccc(C(F)(F)F)cc4)cc3)sc2c1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.59
CSNK1D P48730 1/20 0.57
SCD O00767 4/20 0.57
NPC1 O15118 3/20 0.57
RAB9A P51151 3/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
MAPT P10636 4/20 0.57
PLG P00747 1/20 0.55
PLAU P00749 1/20 0.55
PLAT P00750 1/20 0.55
LMNA P02545 1/20 0.54
TP53 P04637 1/20 0.53
PPARA Q07869 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
SCHEMBL1985009 0.92 SCD (0.67) APPSCDNPC1RAB9AMEN1
SCHEMBL2192465 0.91 PLG (0.61) APPCSNK1DSCDNPC1RAB9A
SCHEMBL2191674 0.91 MAPT (0.56) APPSCDNPC1RAB9AMEN1
SCHEMBL2192963 0.90 APP (0.71) APPSCDNPC1RAB9AMEN1
SCHEMBL16623333 0.89 APP (0.77) APPSCDNPC1RAB9AMEN1
SCHEMBL16623336 0.89 MAPT (0.64) APPSCDNPC1RAB9AMEN1
SCHEMBL2193639 0.89 APP (0.63) APPSCDNPC1RAB9AMEN1
SCHEMBL2191507 0.88 APP (0.71) APPSCDNPC1RAB9AMEN1
SCHEMBL2195695 0.88 RAB9A (0.55) APPSCDNPC1RAB9AMEN1
SCHEMBL2193173 0.88 NPC1 (0.55) APPSCDNPC1RAB9AMEN1

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
EP-2338059-B1 Ligands for aggregated tau molecules WISTA LAB LTD (SG) 2015-04-08 EP disclosed
US-8895313-B2 Ligands for aggregated tau molecules WISTA LABORATORIES LTD. (SG) 2014-11-25 US disclosed
US-8895313-B2 Ligands for aggregated tau molecules WISTA LABORATORIES LTD. (SG) 2014-11-25 US disclosed
CN-102224423-B Ligands for aggregated tau molecules WISTA LABORATORIES LTD. (SG) 2014-10-22 CN disclosed
US-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. 2011-07-14 US disclosed
US-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. 2011-07-14 US disclosed
WO-2010034982-A1 LIGANDS FOR AGGREGATED TAU MOLECULES WISTA LABORATORIES LTD. (SG) 2010-04-01 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-20110171739-A1 LIGANDS FOR AGGREGATED TAU MOLECULES MAPT, PRNP, MAP4 APP 17/4885CSNK1D 307/4885SCD 4644/4885

“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.