SCHEMBL773411

SCHEMBL773411

COc1ccc2sc3nc(-c4ccc(N(C)C(C)=O)cc4)cn3c2c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.55
TP53 P04637 4/20 0.55
RAB9A P51151 3/20 0.55
LMNA P02545 2/20 0.55
TSHR P16473 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
ATM Q13315 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
APP P05067 1/20 0.54
RXFP1 Q9HBX9 1/20 0.52
THRB P10828 3/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
POLB P06746 1/20 0.47
NPC1 O15118 2/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
FLT3 P36888 1/20 0.45

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
SCHEMBL773410 0.92 MAPT (0.67) MAPTTP53RAB9ALMNATSHR
SCHEMBL772551 0.88 TP53 (0.61) MAPTTP53RAB9ALMNATSHR
SCHEMBL772763 0.86 FLT3 (0.46) MAPTTP53RAB9ALMNATSHR
SCHEMBL11035096 0.85 MAPT (0.60) MAPTTP53RAB9ALMNATSHR
SCHEMBL11008475 0.83 MAPT (0.63) MAPTTP53RAB9ALMNATSHR
SCHEMBL772394 0.83 MAPT (0.57) MAPTTP53RAB9ALMNATSHR
SCHEMBL772950 0.82 LMNA (0.66) MAPTTP53RAB9ALMNATSHR
SCHEMBL11037810 0.82 LMNA (0.62) MAPTTP53RAB9ALMNATSHR
SCHEMBL3045414 0.81 MAPT (0.63) MAPTTP53RAB9ALMNATSHR
Bromide SCHEMBL3867316 0.81 TP53 (0.63) MAPTTP53RAB9ALMNATSHR

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-20120070374-A1 Compounds for Non-Invasive Measurement of Aggregates of Amyloid Peptides TECHNISCHE UNIVERSITAT MUNCHEN (DE) 2012-03-22 US disclosed
EP-2218464-A1 Compounds for non-invasive measurement of aggregates of amyloid peptides Technische Universität München (DE) 2010-08-18 EP 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-20120070374-A1 Compounds for Non-Invasive Measurement of Aggregates of Amyloid Peptides IAPP, APP, HTT MAPT 10/4885TP53 619/4885RAB9A 3627/4885

“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.