SCHEMBL12422122

SCHEMBL12422122

CCCCOc1cc(O)ccc1/N=N/c1ccc(-c2nc3ccc(O)cc3s2)c(O)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
RAB9A P51151 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SULT1A1 P50225 3/20 0.41
APP P05067 11/20 0.40
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
MAOB P27338 1/20 0.37
MEN1 O00255 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
ILK Q13418 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL1984564 0.89 KDM4E (0.40) NPC1MAPTKDM4ERAB9ANPSR1
SCHEMBL1984565 0.89 KDM4E (0.40) NPC1MAPTKDM4ERAB9ANPSR1
SCHEMBL12422465 0.88 NPC1 (0.39) NPC1MAPTKDM4ERAB9ANPSR1
SCHEMBL12422107 0.80 MAPT (0.49) NPC1MAPTKDM4ERAB9ANPSR1
SCHEMBL1984147 0.79 SULT1A1 (0.41) NPC1MAPTRAB9ASULT1A1APP
SCHEMBL1984149 0.79 SULT1A1 (0.41) NPC1MAPTRAB9ASULT1A1APP
SCHEMBL1984117 0.76 MAPT (0.46) NPC1MAPTKDM4ERAB9ANPSR1
SCHEMBL1984115 0.76 MAPT (0.46) NPC1MAPTKDM4ERAB9ANPSR1
SCHEMBL12422466 0.69 APP (0.42) NPC1MAPTKDM4ERAB9ANPSR1
SCHEMBL2194030 0.69 SULT1A1 (0.45) NPC1MAPTRAB9ASULT1A1APP

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 NPC1 1265/4885MAPT 1/4885KDM4E 4073/4885

“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.