SCHEMBL10296332

SCHEMBL10296332

COc1cc2c(OC)ncnc2cc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.52
RET P07949 5/20 0.52
KIF5B P33176 3/20 0.52
EGFR P00533 6/20 0.52
LCK P06239 3/20 0.51
TRPA1 O75762 1/20 0.48
GAK O14976 1/20 0.48
RIPK2 O43353 1/20 0.48
STK10 O94804 1/20 0.48
FLT3 P36888 1/20 0.48
JAK3 P52333 1/20 0.48
AAK1 Q2M2I8 1/20 0.48
Q6ZSR9 Q6ZSR9 1/20 0.48
SLK Q9H2G2 1/20 0.48
IRAK4 Q9NWZ3 1/20 0.48
RPS6KA6 Q9UK32 1/20 0.48
ALK Q9UM73 1/20 0.48
AURKB Q96GD4 2/20 0.46
AURKA O14965 1/20 0.45
ENPP1 P22413 2/20 0.45

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
SCHEMBL1985535 0.87 KDR (0.46) KDRRETKIF5BEGFRLCK
SCHEMBL1985538 0.85 LCK (0.66) KDRRETKIF5BEGFRLCK
SCHEMBL7802744 0.84 EGFR (0.53) KDRRETKIF5BEGFRLCK
SCHEMBL20813470 0.83 EGFR (0.52) KDRRETKIF5BEGFRLCK
SCHEMBL11315816 0.83 EGFR (0.52) KDRRETKIF5BEGFRLCK
SCHEMBL6792933 0.82 LCK (0.52) KDRRETKIF5BEGFRLCK
SCHEMBL4025375 0.82 KDR (0.67) KDRRETKIF5BEGFRLCK
SCHEMBL296984 0.81 ENPP1 (0.63) KDRRETKIF5BEGFRLCK
SCHEMBL30054610 0.81 ENPP1 (0.63) KDRRETKIF5BEGFRLCK
SCHEMBL4417590 0.81 PDE5A (0.51) KDRRETKIF5BEGFRLCK

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-8211911-B2 Compounds as kinase inhibitors CHEN GUOQING PAUL (US) 2012-07-03 US disclosed
US-20100048599-A1 Compounds As Kinase Inhibitors CHEN GUOQING PAUL 2010-02-25 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-20100048599-A1 Compounds As Kinase Inhibitors MAP3K1, MAP3K5, MAP3K6 KDR 44/4885RET 155/4885KIF5B 873/4885

“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.