SCHEMBL18154707

SCHEMBL18154707

Cc1nccc(Nc2cc(C)[nH]n2)n1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ITK Q08881 1/20 0.65
▸ KDR P35968 7/20 0.54
▸ IGF1R P08069 7/20 0.54
▸ FGFR1 P11362 5/20 0.54
▸ AURKA O14965 8/20 0.51
▸ AURKB Q96GD4 8/20 0.51
▸ EGFR P00533 3/20 0.47
▸ FLT4 P35916 2/20 0.46
▸ SRC P12931 2/20 0.46
▸ INSR P06213 1/20 0.46
▸ DHODH Q02127 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ PIK3C3 Q8NEB9 1/20 0.42
▸ GSK3A P49840 3/20 0.42
▸ GSK3B P49841 3/20 0.42
▸ DAPK3 O43293 1/20 0.42
▸ JAK2 O60674 1/20 0.42

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
SCHEMBL30230471 1.00 ITK (0.65) ITKKDRIGF1RFGFR1AURKA
SCHEMBL2120764 0.84 ITK (0.62) ITKKDRIGF1RFGFR1AURKA
SCHEMBL29537888 0.84 ITK (0.62) ITKKDRIGF1RFGFR1AURKA
SCHEMBL18154778 0.81 ITK (0.59) ITKKDRIGF1RFGFR1AURKA
SCHEMBL18297005 0.80 ITK (0.58) ITKKDRIGF1RFGFR1AURKA
SCHEMBL802275 0.79 ITK (1.00) ITKKDRIGF1RFGFR1AURKA
SCHEMBL13675364 0.79 ITK (0.56) ITKKDRIGF1RFGFR1AURKA
SCHEMBL18154760 0.79 ITK (0.56) ITKKDRIGF1RFGFR1AURKA
SCHEMBL12060073 0.79 NEK1 (0.64) IGF1RSRCPAK4
SCHEMBL30353181 0.78 ITK (0.55) ITKKDRIGF1RFGFR1AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023168686-A1 SUBSTITUTED CYCLOPENTANES AS CDK2 INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2023-09-14 — — WO disclosed
US-11612604-B2 Methods of treating cancer with PLK4 inhibitors LUDWIG INSTITUTE FOR CANCER RESEARCH LTD (CH) 2023-03-28 — — US disclosed
EP-3283482-A1 PLK4 INHIBITORS Ludwig Institute for Cancer Research Ltd (CH) 2018-02-21 — — EP disclosed
WO-2016166604-A1 PLK4 INHIBITORS LUDWIG INSTITUTE FOR CANCER RESEARCH LTD (CH) 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-11612604-B2 Methods of treating cancer with PLK4 inhibitors PLK4, PLK2, PLK3 ITK 1823/4885KDR 1853/4885IGF1R 1819/4885

“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.

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