SCHEMBL2025916

SCHEMBL2025916

Cc1ccc(Nc2nccn3c(N)nnc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.43
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
AHR P35869 1/20 0.43
LRRK2 Q5S007 1/20 0.40
HAVCR2 Q8TDQ0 1/20 0.39
GAA P10253 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
EGFR P00533 1/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 2/20 0.36
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 1/20 0.36

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
SCHEMBL12476722 0.85 MAPT (0.42) MAPTRAB9ANPC1SMN1; SMN2EGFR
SCHEMBL2023859 0.85 MEN1 (0.40) RAB9ASMN1; SMN2AHRLRRK2KDM4E
SCHEMBL2020560 0.85 CCNE2 (0.40) MAPTRAB9ANPC1EGFRKDM4E
SCHEMBL12575062 0.85 BRD4 (0.47) MAPTRAB9ANPC1SMN1; SMN2AHR
SCHEMBL2019924 0.85 KDR (0.39) MAPTZAP70SYKKARS1BRD4
SCHEMBL12476987 0.85 EGFR (0.41) MAPTRAB9ANPC1SMN1; SMN2GAA
SCHEMBL2024279 0.85 MAPT (0.52) MAPTRAB9ANPC1SMN1; SMN2GAA
SCHEMBL2022423 0.85 SMN1; SMN2 (0.45) MAPTRAB9ANPC1SMN1; SMN2GAA
SCHEMBL2024473 0.83 MAPT (0.54) MAPTTDP1EGFRLMNAKDM4E
SCHEMBL12574976 0.82 IKBKB (0.41) MAPTRAB9ANPC1SMN1; SMN2AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8329705-B2 Substituted triazolo-pyrazine compounds ARQULE, INC. (US) 2012-12-11 US disclosed
US-8329705-B2 Substituted triazolo-pyrazine compounds ARQULE, INC. (US) 2012-12-11 US disclosed
US-8329705-B2 Substituted triazolo-pyrazine compounds ARQULE, INC. (US) 2012-12-11 US disclosed
WO-2011082267-A2 SUBSTITUTED TRIAZOLO-PYRAZINE COMPOUNDS ARQULE, INC. (US) 2011-07-07 WO disclosed
US-20110160215-A1 Substituted Triazolo-Pyrazine Compounds ARQULE, INC. (US) 2011-06-30 US disclosed
US-20110160215-A1 Substituted Triazolo-Pyrazine Compounds ARQULE, INC. (US) 2011-06-30 US disclosed
US-20110160215-A1 Substituted Triazolo-Pyrazine Compounds ARQULE, INC. (US) 2011-06-30 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-20110160215-A1 Substituted Triazolo-Pyrazine Compounds MKI67, TP53, THPO MAPT 2493/4885RAB9A 3244/4885NPC1 803/4885

“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.