SCHEMBL3597039

SCHEMBL3597039

CN1CCC(N(C)c2nc(Nc3ccc(-c4cnco4)cc3)c3ncn(-c4cscn4)c3n2)CC1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.34
JAK3 P52333 1/20 0.34
GPR119 Q8TDV5 5/20 0.34
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
AXL P30530 3/20 0.33
CD38 P28907 1/20 0.33
WNT1 P04628 3/20 0.32
GSK3B P49841 3/20 0.32
DYRK1A Q13627 3/20 0.32
TRPV1 Q8NER1 1/20 0.32
NMT1 P30419 1/20 0.31
FLT3 P36888 1/20 0.31

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
SCHEMBL3596341 0.83 CSNK1D (0.40) FLT3
SCHEMBL1590653 0.82 LMNA (0.40) AXLNMT1FLT3
SCHEMBL4444408 0.82 AXL (0.36) SYKJAK3GPR119AXLNMT1
SCHEMBL6015418 0.82 FLT3 (0.37) AXLNMT1FLT3
SCHEMBL6015423 0.74 SRC (0.44)
SCHEMBL3589066 0.72 ABL1 (0.41) FLT3
SCHEMBL10155224 0.63 BTK (0.46) JAK3
SCHEMBL4442975 0.63 FLT3 (0.57) FLT3
SCHEMBL1591304 0.63 FLT3 (0.56) FLT3
SCHEMBL4444458 0.62 FLT3 (0.59) FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056494-A1 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2010-03-04 US claimed
EP-2124954-A2 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2009-12-02 EP claimed
WO-2008094737-A2 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2008-08-07 WO claimed
US-20100056494-A1 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2010-03-04 US disclosed
EP-2124954-A2 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2009-12-02 EP disclosed
WO-2008094737-A2 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2008-08-07 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-20100056494-A1 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES ADK, PNP, DCK SYK 442/4885JAK3 473/4885GPR119 1115/4885

“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.