SCHEMBL804976

SCHEMBL804976

CN(C)c1ccc(-c2cn3c(n2)sc2cc(C(F)(F)F)ccc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.48
MAPT P10636 4/20 0.48
TP53 P04637 3/20 0.48
TSHR P16473 1/20 0.48
RAB9A P51151 1/20 0.48
ATM Q13315 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
APP P05067 2/20 0.47
RXFP1 Q9HBX9 1/20 0.43
F2RL3 Q96RI0 1/20 0.41
THRB P10828 2/20 0.41
MET P08581 2/20 0.41
FLT3 P36888 1/20 0.40

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
SCHEMBL13290981 0.85 MAPT (0.51) LMNAMAPTTP53TSHRRAB9A
SCHEMBL3038362 0.85 MAPT (0.51) LMNAMAPTTP53TSHRRAB9A
SCHEMBL13198307 0.84 TP53 (0.66) LMNAMAPTTP53TSHRRAB9A
SCHEMBL3049440 0.83 LMNA (0.53) LMNAMAPTTP53TSHRRAB9A
SCHEMBL13198299 0.82 MAPT (0.51) LMNAMAPTTP53TSHRRAB9A
SCHEMBL13290974 0.82 LMNA (0.51) LMNAMAPTTP53TSHRRAB9A
SCHEMBL3045446 0.82 LMNA (0.51) LMNAMAPTTP53TSHRRAB9A
SCHEMBL31338679 0.82 LMNA (0.53) LMNAMAPTTP53TSHRRAB9A
SCHEMBL804656 0.82 LMNA (0.51) LMNAMAPTTP53TSHRRAB9A
SCHEMBL774396 0.82 FLT3 (0.53) LMNAMAPTTP53TSHRRAB9A

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 LMNA 1196/4885MAPT 10/4885TP53 619/4885

“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.