SCHEMBL31435972

SCHEMBL31435972

CCc1c(-c2cccc(C(F)F)c2)c2cc(-c3cn(C4CCN(C)CC4)nc3OC)cnc2n1S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
AXL P30530 1/20 0.31
ROS1 P08922 1/20 0.31
ALK Q9UM73 1/20 0.31
ACVR1 Q04771 1/20 0.30
MTOR P42345 1/20 0.30

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
SCHEMBL31435974 0.92 ELANE (0.32) ELANEGRIN1GRIN2B
SCHEMBL31436018 0.92 CHRM3 (0.34) AXLACVR1MTOR
SCHEMBL31435925 0.87 KCNH2 (0.38) AXLACVR1MTOR
SCHEMBL31435904 0.85 PTPN11 (0.39) GRIN1GRIN2BAXLROS1ALK
SCHEMBL31436005 0.84 MAP4K3 (0.37) ALKMTOR
SCHEMBL31435940 0.84 MET (0.35) AXLACVR1MTOR
SCHEMBL31435911 0.83 JAK2 (0.35) AXLACVR1MTOR
SCHEMBL31435973 0.83 CYP3A4 (0.35) AXLACVR1MTOR
SCHEMBL31435961 0.80 KCNH2 (0.38) AXLACVR1MTOR
SCHEMBL31435941 0.79 AXL (0.32) ELANEGRIN1GRIN2BAXLACVR1

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 ELANE 3500/4885GRIN1 1703/4885GRIN2B 534/4885

“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.