SCHEMBL31436028

SCHEMBL31436028

CCc1c(-c2ccc(OC)nc2)c2cc(-c3cn(C4CCNCC4)nc3Cl)cnc2n1S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 3/20 0.36
CSF1R P07333 3/20 0.36
NTRK2 Q16620 3/20 0.36
PIK3CA P42336 4/20 0.35
MTOR P42345 1/20 0.35
ATM Q13315 1/20 0.35
ATR Q13535 1/20 0.35
BRD4 O60885 1/20 0.35
ATAD2 Q6PL18 1/20 0.35
KRAS P01116 1/20 0.34
PLAT P00750 1/20 0.34
PAK1 Q13153 2/20 0.32
MET P08581 1/20 0.32
GRK2 P25098 1/20 0.32
GRK5 P34947 1/20 0.32
KCNH2 Q12809 3/20 0.32
ALK Q9UM73 2/20 0.31
RIPK3 Q9Y572 1/20 0.31
RET P07949 1/20 0.31
RIOK2 Q9BVS4 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
SCHEMBL31435912 0.92 NTRK1 (0.36) NTRK1CSF1RNTRK2PIK3CAMTOR
SCHEMBL31435961 0.92 KCNH2 (0.38) PIK3CAMTORKRASKCNH2RET
SCHEMBL31436008 0.92 NTRK1 (0.37) NTRK1CSF1RNTRK2PIK3CAMTOR
SCHEMBL31435980 0.87 MAP4K3 (0.38) PAK1METGRK2GRK5ALK
SCHEMBL31435955 0.84 PTPN11 (0.42) NTRK1CSF1RNTRK2PIK3CAMTOR
SCHEMBL31435925 0.84 KCNH2 (0.38) PIK3CAMTORKRASKCNH2RET
SCHEMBL31435914 0.83 TNF (0.35) PIK3CAMTORKRASMETKCNH2
SCHEMBL31436005 0.82 MAP4K3 (0.37) PIK3CAMTORPAK1METGRK2
SCHEMBL31435900 0.80 MAP4K3 (0.41) PAK1METGRK2GRK5ALK
SCHEMBL31435954 0.78 PTPN11 (0.43) NTRK1CSF1RNTRK2PIK3CAMTOR

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 NTRK1 266/4885CSF1R 1635/4885NTRK2 346/4885

“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.