SCHEMBL4882881

SCHEMBL4882881

C#Cc1cccc(-c2cnc(N)nc2Nc2ccc3nc(C)oc3c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.41
KDR P35968 2/20 0.41
PDGFRB P09619 1/20 0.41
PIK3CA P42336 1/20 0.40
IDO1 P14902 2/20 0.38
TDO2 P48775 2/20 0.38
ABCG2 Q9UNQ0 1/20 0.37
ALDH1A1 P00352 4/20 0.36
POLB P06746 1/20 0.36
ERBB2 P04626 1/20 0.35
ERBB4 Q15303 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ADORA1 P30542 1/20 0.34
SYK P43405 1/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
GAK O14976 1/20 0.34

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
SCHEMBL6313338 0.81 EGFR (0.45) EGFRKDRPIK3CAABCG2ALDH1A1
SCHEMBL6313300 0.76 ABCG2 (0.46) EGFRKDRPIK3CAIDO1ABCG2
SCHEMBL3454584 0.71 EGFR (0.46) EGFRKDRPDGFRBIDO1TDO2
SCHEMBL6319179 0.71 ADORA2A (0.46) EGFRABCG2ALDH1A1SYKMAPT
SCHEMBL4611264 0.69 DHFR (0.61) ADORA1
SCHEMBL24251899 0.68 ALDH1A1 (0.44) EGFRKDRPDGFRBALDH1A1POLB
SCHEMBL27997869 0.66 SYK (0.55) EGFRKDRPIK3CAABCG2ADORA1
SCHEMBL615340 0.63 SMN1; SMN2 (0.58) ALDH1A1POLBSMN1; SMN2MAPTKDM4E
SCHEMBL6319566 0.63 MAP4K4 (0.44) EGFRPIK3CAABCG2ALDH1A1ERBB2
SCHEMBL15880299 0.63 KIT (0.40) KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 EGFR 81/4885KDR 2/4885PDGFRB 387/4885

“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.