SCHEMBL14907686

SCHEMBL14907686

S=NCc1ncnc2[nH]ccc12

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.44
AKT2 P31751 1/20 0.42
GSK3B P49841 1/20 0.42
TTBK1 Q5TCY1 5/20 0.41
TTBK2 Q6IQ55 5/20 0.41
JAK3 P52333 4/20 0.41
CDC7 O00311 1/20 0.41
DBF4 Q9UBU7 1/20 0.41
NOTUM Q6P988 1/20 0.41
TRPA1 O75762 2/20 0.41
HPGDS O60760 1/20 0.40
HTR2C P28335 1/20 0.40
CSF1R P07333 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
SCHEMBL14894293 0.82 JAK2 (0.41) JAK2AKT2GSK3BTTBK1TTBK2
SCHEMBL24345975 0.78 AKT2 (0.50) JAK2AKT2GSK3BTTBK1TTBK2
SCHEMBL14355258 0.77 JAK2 (0.47) JAK2AKT2GSK3BTTBK1TTBK2
Hydrochloric Acid SCHEMBL4974811 0.77 AKT2 (0.49) JAK2AKT2GSK3BTTBK1TTBK2
SCHEMBL4006768 0.77 TTBK1 (0.48) JAK2AKT2GSK3BTTBK1TTBK2
SCHEMBL20220690 0.74 TTBK1 (0.49) JAK2AKT2GSK3BTTBK1TTBK2
SCHEMBL14907971 0.72 PRKCI (0.49) JAK2JAK3CSF1R
SCHEMBL12561826 0.72 JAK3 (0.44) JAK2AKT2GSK3BTTBK1TTBK2
SCHEMBL24262375 0.71 NOTUM (0.57) JAK2GSK3BTTBK1TTBK2JAK3
SCHEMBL8929582 0.71 CDC7 (0.57) JAK2TTBK1TTBK2JAK3CDC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9174984-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-11-03 US disclosed
US-9174984-B2 Chemical compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-11-03 US disclosed
US-20140296204-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2014-10-02 US disclosed
US-20140296204-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2014-10-02 US disclosed
WO-2013062945-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-05-02 WO 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-20140296204-A1 CHEMICAL COMPOUNDS DNMT1, DNMT3A, DNMT3B JAK2 381/4885AKT2 1487/4885GSK3B 50/4885

“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.