SCHEMBL31435945

SCHEMBL31435945

COc1nn(C2CCN(C)CC2)cc1-c1cnc2[nH]cc(-c3ccnc(C(F)F)c3)c2c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 12/20 0.47
IL2 P60568 7/20 0.47
MAP3K11 Q16584 1/20 0.40
KIT P10721 3/20 0.39
PIK3CA P42336 1/20 0.39
TNIK Q9UKE5 1/20 0.39
SIK1 P57059 1/20 0.38
SIK3 Q9Y2K2 1/20 0.38
DYRK1A Q13627 1/20 0.38

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
SCHEMBL31435981 0.87 MAP4K1 (0.47) MAP4K1IL2MAP3K11KITTNIK
SCHEMBL31435943 0.85 KIT (0.52) MAP4K1IL2KITTNIKSIK1
SCHEMBL31435918 0.83 MAP4K1 (0.51) MAP4K1IL2MAP3K11KITTNIK
SCHEMBL31435924 0.82 MAP4K1 (0.43) MAP4K1IL2MAP3K11TNIK
SCHEMBL31435982 0.82 KIT (0.49) MAP4K1IL2MAP3K11KITTNIK
SCHEMBL31435903 0.80 KIT (0.51) MAP4K1IL2KITSIK1SIK3
SCHEMBL31435917 0.77 KIT (0.55) MAP4K1IL2KITDYRK1A
SCHEMBL31435913 0.77 MAP4K1 (0.48) MAP4K1IL2MAP3K11TNIK
SCHEMBL31435968 0.77 MAP4K1 (0.49) MAP4K1IL2KITTNIKSIK1
SCHEMBL31435906 0.76 MAP4K1 (0.43) MAP4K1IL2KITTNIK

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-20250019378-A1 PYRROLE[2,3-B]PYRIDINE DERIVATIVES AS TYRO3 INHIBITORS HALIA THERAPEUTICS INC (US) 2025-01-16 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-20250019378-A1 PYRROLE[2,3-B]PYRIDINE DERIVATIVES AS TYRO3 INHIBITORS TYRO3, TH, TYR MAP4K1 438/4885IL2 4619/4885MAP3K11 327/4885

“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.