SCHEMBL414365

SCHEMBL414365

COc1ccc2cc1OCCNC(=O)[C@@H]1CN(CC[C@H]1C(=O)N1CCN(C)CC1)Cc1cccc(c1)Nc1cc(ncn1)N2

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.39
JAK2 O60674 2/20 0.39
CCNA2 P20248 2/20 0.39
CDK2 P24941 2/20 0.39
CCNA1 P78396 2/20 0.39
AXL P30530 1/20 0.33
TYRO3 Q06418 1/20 0.33
MERTK Q12866 1/20 0.33
BRD4 O60885 1/20 0.30
MAPK7 Q13164 1/20 0.30
MKNK1 Q9BUB5 1/20 0.30

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
SCHEMBL415905 1.00 FLT3 (0.39) FLT3JAK2CCNA2CDK2CCNA1
SCHEMBL463810 0.79 EGFR (0.36) FLT3AXLTYRO3MERTK
SCHEMBL415863 0.77 CDK2 (0.49) FLT3JAK2CCNA2CDK2CCNA1
SCHEMBL463769 0.77 FLT3 (0.40) FLT3JAK2CCNA2CDK2CCNA1
SCHEMBL415811 0.77 FLT3 (0.40) FLT3JAK2CCNA2CDK2CCNA1
SCHEMBL414868 0.77 FLT3 (0.40) FLT3JAK2CCNA2CDK2CCNA1
SCHEMBL10258190 0.77 FLT3 (0.40) FLT3JAK2CCNA2CDK2CCNA1
SCHEMBL463800 0.77 JAK2 (0.33) FLT3JAK2CCNA2CDK2CCNA1
SCHEMBL413775 0.76 JAK2 (0.40) FLT3JAK2CCNA2CDK2CCNA1
SCHEMBL10258292 0.76 JAK2 (0.42) FLT3JAK2CCNA2CDK2CCNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065395-A1 2,4 (4,6) PYRIMIDINE DERIVATIVES FREYNE EDDY JEAN EDGARD (BE) 2012-03-15 US disclosed
US-20120065395-A1 2,4 (4,6) PYRIMIDINE DERIVATIVES FREYNE EDDY JEAN EDGARD (BE) 2012-03-15 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-20120065395-A1 2,4 (4,6) PYRIMIDINE DERIVATIVES NR0B1, NR1H3, NCOA3 FLT3 2149/4885JAK2 2835/4885CCNA2 1274/4885

“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.