SCHEMBL2024237

SCHEMBL2024237

Cc1ccc(CNc2nccn3c(N)nnc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
THRB P10828 1/20 0.44
ADORA3 P0DMS8 7/20 0.43
ADORA2A P29274 1/20 0.43
NPC1 O15118 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
APP P05067 1/20 0.40
HPGD P15428 1/20 0.40
MAPK8 P45983 1/20 0.39
RXFP1 Q9HBX9 2/20 0.39
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 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
SCHEMBL2025922 0.90 ADORA3 (0.43) ADORA3ADORA2AMAPK8
SCHEMBL12481449 0.88 ADORA3 (0.46) ADORA3ADORA2A
SCHEMBL2024005 0.87 GALR3 (0.50) MAPTADORA3ADORA2ANPC1SMN1; SMN2
SCHEMBL2016668 0.87 ADORA3 (0.44) ALDH1A1KDM4EADORA3ADORA2AHTT
SCHEMBL2019917 0.87 ADORA3 (0.56) KDM4EADORA3ADORA2AAPP
SCHEMBL2018131 0.87 ADORA3 (0.43) ADORA3ADORA2AAPPMAPK8MEN1
SCHEMBL12575053 0.86 MAPT (0.46) MAPTALDH1A1KDM4ETHRBADORA3
SCHEMBL12476646 0.86 ADORA3 (0.55) ALDH1A1KDM4EADORA3ADORA2AHPGD
SCHEMBL2027771 0.86 ADORA3 (0.41) ADORA3ADORA2AMAPK8
SCHEMBL2025860 0.86 ZAP70 (0.50) ADORA3NPC1APP

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 2493/4885ALDH1A1 1473/4885KDM4E 3014/4885

“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.