SCHEMBL14768763

SCHEMBL14768763

Cc1ccc2nnn(-c3ccccc3)c2n1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 6/20 0.52
GSK3A P49840 3/20 0.49
GSK3B P49841 3/20 0.49
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.42
NPC1 O15118 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
AURKA O14965 1/20 0.41
FCGR1A P12314 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.39

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
SCHEMBL14768735 0.81 PIM1 (0.62) PIM1ALDH1A1KDM4ENPC1LMNA
SCHEMBL9996823 0.78 PIM1 (0.51) PIM1GSK3AGSK3BMEN1KMT2A
SCHEMBL9996735 0.75 PIM1 (0.43) PIM1GSK3AGSK3BMEN1KMT2A
SCHEMBL9996827 0.73 PDE10A (0.47) PIM1GSK3AGSK3BMEN1KMT2A
SCHEMBL31227216 0.72 PPARA (0.40) PIM1MEN1KMT2AALDH1A1KDM4E
SCHEMBL19848719 0.72 KDM4E (0.53) MEN1KMT2AALDH1A1KDM4EHTT
SCHEMBL4868335 0.72 SLC9A1 (0.41) KDM4ELMNA
SCHEMBL11851657 0.71 KDM4E (0.50) PIM1GSK3AGSK3BALDH1A1KDM4E
SCHEMBL24024712 0.70 ALDH1A1 (0.52) PIM1GSK3AGSK3BMEN1KMT2A
SCHEMBL540987 0.70 MAPK1 (0.56) MEN1KMT2AALDH1A1KDM4EHTT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130065883-A1 Triazolo [4, 5- B] Pyridin Derivatives Centro Nacional de Investigaceiones Oncologicas (CNIO) (ES) 2013-03-14 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-20130065883-A1 Triazolo [4, 5- B] Pyridin Derivatives PIM1, PIM3, PIM2 PIM1 1/4885GSK3A 389/4885GSK3B 283/4885

“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.