SCHEMBL18158230

SCHEMBL18158230

COc1cc2ncnc(Nc3cccc(Oc4ccccc4C)c3)c2cc1OC

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.77
RET P07949 4/20 0.77
SRC P12931 3/20 0.77
EGFR P00533 16/20 0.69
EPHB2 P29323 3/20 0.67
LCK P06239 3/20 0.67
RIPK2 O43353 1/20 0.67
KDM4E B2RXH2 3/20 0.65
MAPT P10636 3/20 0.65
MAPK1 P28482 3/20 0.65
MAPK14 Q16539 3/20 0.65
ABL1 P00519 2/20 0.65
CYP1A2 P05177 2/20 0.65
CYP3A4 P08684 2/20 0.65
FBP1 P09467 2/20 0.65
CYP2D6 P10635 2/20 0.65
MKNK1 Q9BUB5 2/20 0.65
ERBB2 P04626 2/20 0.65
MAPK13 O15264 2/20 0.65
MAPK12 P53778 2/20 0.65

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
SCHEMBL18158549 0.90 EGFR (0.79) KDRRETSRCEGFREPHB2
SCHEMBL18158215 0.90 EGFR (0.82) KDRRETSRCEGFREPHB2
Hydrochloric Acid SCHEMBL8811926 0.89 EGFR (0.80) KDRRETSRCEGFREPHB2
SCHEMBL18158214 0.88 KDR (0.75) KDRRETSRCEGFREPHB2
SCHEMBL5474772 0.87 KDR (1.00) KDRRETSRCEGFREPHB2
SCHEMBL18158236 0.87 EGFR (0.77) KDRRETSRCEGFREPHB2
SCHEMBL18158544 0.87 EGFR (0.77) KDRRETSRCEGFREPHB2
Hydrochloric Acid SCHEMBL5483854 0.86 KDR (0.97) KDRRETSRCEGFREPHB2
SCHEMBL18158234 0.84 EGFR (0.83) KDRRETSRCEGFREPHB2
SCHEMBL18158231 0.84 EGFR (0.83) KDRRETSRCEGFREPHB2

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-10548897-B2 KSR antagonists ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2020-02-04 US disclosed
WO-2016168704-A1 KSR ANTAGONISTS ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2016-10-20 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-10548897-B2 KSR antagonists KSR1, KSR2, KRAS KDR 1123/4885RET 321/4885SRC 133/4885

“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.