SCHEMBL4883302

SCHEMBL4883302

c1cnc(Nc2cccc(OC3CCOCC3)c2)nc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.51
TBK1 Q9UHD2 4/20 0.47
IKBKE Q14164 1/20 0.46
GRM4 Q14833 1/20 0.43
EGFR P00533 3/20 0.43
ERBB2 P04626 1/20 0.43
MTOR P42345 1/20 0.42
SMG1 Q96Q15 1/20 0.42
MAPK1 P28482 1/20 0.42
JAK2 O60674 1/20 0.41
GRM5 P41594 1/20 0.41
EPHB4 P54760 1/20 0.41
LRRK2 Q5S007 2/20 0.40
PLK4 O00444 1/20 0.40

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
SCHEMBL20242759 0.79 SYK (0.43) SYKTBK1EGFRERBB2JAK2
SCHEMBL14024429 0.77 SYK (0.53) SYKEGFRJAK2PLK4
SCHEMBL4883637 0.77 PDE4A (0.49) EGFR
SCHEMBL14024582 0.76 KDR (0.56) SYKTBK1PLK4
SCHEMBL20242735 0.73 EGFR (0.41) SYKTBK1GRM4EGFR
SCHEMBL3459344 0.72 SRC (0.59) SYKEGFR
SCHEMBL29877093 0.72 CYP3A4 (0.48) SYKMAPK1GRM5
SCHEMBL2627279 0.71 CYP3A4 (0.46) SYK
SCHEMBL30098499 0.71 CYP3A4 (0.46) SYK
SCHEMBL2284267 0.71 EGFR (0.72) SYKGRM4EGFRMAPK1

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-8349859-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2013-01-08 US disclosed
US-20080255172-A1 N4-(2-methyl-1H-indol-5-yl)-N2-phenylpyrimidine-2,4-diamine; angiogenesis related disorder like cancer or age-related macular degeneration HUTCHISON MEDIPHARMA ENTERPRISES LIMETED (BS) 2008-10-16 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-20080255172-A1 N4-(2-methyl-1H-indol-5-yl)-N2-phenylpyrimidine-2,4-diamine; angiogenesis related disorder like cancer or age-related macular degeneration CCND2, KDR, FLT4 SYK 2248/4885TBK1 2166/4885IKBKE 2932/4885

“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.