SCHEMBL3459285

SCHEMBL3459285

CSc1nc(C)cc(NCc2ccccc2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.56
HTT P42858 8/20 0.56
KDM4E B2RXH2 5/20 0.56
MAPT P10636 5/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
ALDH1A1 P00352 3/20 0.56
HPGD P15428 2/20 0.56
HSD17B10 Q99714 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
GAA P10253 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
ALOX15 P16050 1/20 0.56
CASP1 P29466 1/20 0.56
ATM Q13315 1/20 0.56
SMN1; SMN2 Q16637 5/20 0.54
GPR55 Q9Y2T6 1/20 0.54
TP53 P04637 2/20 0.53
TSHR P16473 1/20 0.53
MAPK1 P28482 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
SCHEMBL12321866 0.84 MEN1 (0.53) LMNAKDM4EMAPTMEN1KMT2A
SCHEMBL3459282 0.84 SMN1; SMN2 (0.51) LMNAHTTKDM4EMAPTMEN1
SCHEMBL13329877 0.81 LMNA (0.77) LMNAHTTKDM4EMAPTMEN1
SCHEMBL6128195 0.78 MEN1 (0.72) LMNAHTTKDM4EMAPTMEN1
SCHEMBL4216805 0.78 LMNA (0.58) LMNAHTTKDM4EMAPTMEN1
SCHEMBL1901552 0.77 KMT2A (0.54) LMNAHTTMAPTMEN1KMT2A
SCHEMBL8075835 0.77 SMN1; SMN2 (0.61) LMNAHTTHSD17B10GAASMN1; SMN2
SCHEMBL21672224 0.75 LMNA (0.56) LMNAHTTKDM4EMAPTMEN1
SCHEMBL13329901 0.75 LMNA (0.81) LMNAHTTKDM4EMAPTMEN1
SCHEMBL3461164 0.74 HTT (0.60) LMNAHTTKDM4EMAPTMEN1

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-7816353-B2 P70S6 kinase modulators and method of use EXELIXIS, INC. (US) 2010-10-19 US disclosed
US-20070208020-A1 P70S6 Kinase Modulators And Method Of Use EXELIXIS, INC. 2007-09-06 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-20070208020-A1 P70S6 Kinase Modulators And Method Of Use EEF2K, RPS6KA3, MTOR LMNA 3817/4885HTT 2468/4885KDM4E 1347/4885

“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.