SCHEMBL2194236

SCHEMBL2194236

Cc1ccc2nc(-c3ccc(/C=C/c4ccc(N(C)CCO)cc4)cc3)cn2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 15/20 0.60
NPC1 O15118 5/20 0.53
RAB9A P51151 4/20 0.53
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
PAX8 Q06710 2/20 0.53
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
MITF O75030 1/20 0.53
KDM5A P29375 1/20 0.53
KDM5C P41229 1/20 0.53
HPGD P15428 2/20 0.47
PKM P14618 2/20 0.47
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
CDK5 Q00535 1/20 0.47
CDK5R1 Q15078 1/20 0.47
HSD17B10 Q99714 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46

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
SCHEMBL2194242 1.00 APP (0.60) APPNPC1RAB9AKDM4EALDH1A1
SCHEMBL12509369 0.83 APP (0.50) APPNPC1RAB9AKDM4EALDH1A1
SCHEMBL12422406 0.81 APP (0.51) APPNPC1RAB9AKDM4EALDH1A1
SCHEMBL1986395 0.76 NPC1 (0.67) APPNPC1RAB9AKDM4EALDH1A1
SCHEMBL1986394 0.76 NPC1 (0.67) APPNPC1RAB9AKDM4EALDH1A1
SCHEMBL22907020 0.76 SMN1; SMN2 (0.60) APPNPC1RAB9AKDM4EALDH1A1
SCHEMBL14076014 0.76 APP (1.00) APPNPC1RAB9AKDM4EALDH1A1
SCHEMBL13480654 0.76 NPC1 (0.70) APPNPC1RAB9AKDM4EALDH1A1
SCHEMBL12509006 0.74 NPC1 (0.63) APPNPC1RAB9AKDM4EALDH1A1
SCHEMBL396368 0.72 NPC1 (1.00) APPNPC1RAB9AKDM4EALDH1A1

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 8 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
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
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 17/4885NPC1 1265/4885RAB9A 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.