SCHEMBL1203319

SCHEMBL1203319

CN(C(=O)c1cnc2ccc(NCc3ccc(F)cc3)nn12)c1ccc(O)cc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.62
▸ FYN P06241 8/20 0.52
▸ NTRK1 P04629 5/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ NTRK3 Q16288 2/20 0.41
▸ NTRK2 Q16620 2/20 0.41
▸ IKBKB O14920 2/20 0.41
▸ MKNK1 Q9BUB5 4/20 0.40
▸ TGFBR1 P36897 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
SCHEMBL1203800 0.89 FYN (0.53) PIM1FYNNTRK1IKBKB
SCHEMBL1203203 0.85 PIM1 (0.42) PIM1FYNMKNK1TGFBR1
SCHEMBL1202963 0.84 PIM1 (0.43) PIM1FYNTGFBR1
SCHEMBL1203100 0.81 PIM1 (0.66) PIM1FYNNTRK1KDM4ENTRK3
SCHEMBL1203202 0.80 NTRK1 (0.46) PIM1FYNNTRK1KDM4ENTRK3
SCHEMBL1202088 0.80 FYN (0.63) PIM1FYNNTRK1KDM4ENTRK3
SCHEMBL1202162 0.80 FYN (0.51) PIM1FYNNTRK1KDM4ENTRK3
SCHEMBL2902453 0.79 PIM1 (0.61) PIM1FYNNTRK1NTRK3NTRK2
SCHEMBL1051257 0.77 PIM1 (1.00) PIM1FYNNTRK1NTRK3NTRK2
SCHEMBL1202066 0.77 FYN (0.56) PIM1FYNNTRK1KDM4ENTRK3

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-20110046127-A1 Imidazopyridazines for Use as Protein Kinase Inhibitors CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO) (ES) 2011-02-24 — — 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-20110046127-A1 Imidazopyridazines for Use as Protein Kinase Inhibitors PIM1, PIM3, PIM2 PIM1 1/4885FYN 403/4885NTRK1 755/4885

“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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