SCHEMBL1695290

SCHEMBL1695290

Cc1nnc2ccc(Sc3ccc(N)cc3)cn12

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
MAPK14 Q16539 14/20 0.36
MAPK13 O15264 1/20 0.36
APP P05067 1/20 0.36
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
LRRK2 Q5S007 1/20 0.33

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
SCHEMBL16686865 0.81 PIM1 (0.38)
SCHEMBL1695267 0.78 KDM4E (0.41) MAPK14MAPK13APP
SCHEMBL1695558 0.74 MAPK14 (0.40) MAPK14MAPTMEN1KMT2A
SCHEMBL20343820 0.73 MAPK14 (0.33) MAPK14MAPK13
SCHEMBL1695177 0.69 SMN1; SMN2 (0.41) MEN1KMT2A
SCHEMBL1579040 0.69 MET (0.41) CYP3A4TSHRMAPK1APP
SCHEMBL5765684 0.69 MAPK14 (0.49) TSHRMAPK14MAPK13MAPT
SCHEMBL5765239 0.68 MAPK14 (0.53) MAPK14MAPK13MEN1KMT2A
SCHEMBL5766791 0.68 MAPK14 (0.47) MAPK14LRRK2
4,4'-Thiodianiline SCHEMBL49068 0.67 CYP3A4 (1.00) CYP3A4TSHRMAPK1MAPTMEN1

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-8557797-B2 Triazolopyridine derivatives and their therapeutic use CHIESI FARMACEUTICI S.P.A. (IT) 2013-10-15 US disclosed
US-20120088763-A1 TRIAZOLOPYRIDINE DERIVATIVES AND THEIR THERAPEUTIC USE CHIESI FARMACEUTICI S.P.A. (IT) 2012-04-12 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-20120088763-A1 TRIAZOLOPYRIDINE DERIVATIVES AND THEIR THERAPEUTIC USE CNKSR1, MOK, MAPK1 CYP3A4 1722/4885TSHR 565/4885MAPK1 3/4885

“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.