SCHEMBL31435937

SCHEMBL31435937

CCOc1nn(C2CCNCC2)cc1-c1cnc2c(c1)c(-c1ccc(OC)nc1)cn2S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.43
BRD4 O60885 1/20 0.38
ATAD2 Q6PL18 1/20 0.38
PIK3CA P42336 7/20 0.37
MTOR P42345 6/20 0.37
ATM Q13315 1/20 0.37
ATR Q13535 1/20 0.37
PLAT P00750 1/20 0.36
NTRK1 P04629 2/20 0.36
CSF1R P07333 2/20 0.36
NTRK2 Q16620 2/20 0.36
KCNH2 Q12809 2/20 0.34
RET P07949 2/20 0.34
AKT1 P31749 2/20 0.33
KRAS P01116 1/20 0.33
PAK1 Q13153 1/20 0.33
MET P08581 1/20 0.33
GRK2 P25098 1/20 0.33
GRK5 P34947 1/20 0.33
PIK3CD O00329 1/20 0.32

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
SCHEMBL31435953 0.94 PTPN11 (0.43) PTPN11BRD4ATAD2PIK3CAMTOR
SCHEMBL31435970 0.91 PTPN11 (0.43) PTPN11BRD4PIK3CAMTORKCNH2
SCHEMBL31435954 0.90 PTPN11 (0.43) PTPN11BRD4ATAD2PIK3CAMTOR
SCHEMBL31435919 0.90 PTPN11 (0.43) PTPN11BRD4ATAD2PIK3CAMTOR
SCHEMBL31435955 0.89 PTPN11 (0.42) PTPN11BRD4ATAD2PIK3CAMTOR
SCHEMBL31435984 0.89 PTPN11 (0.42) PTPN11BRD4KCNH2RETPAK1
SCHEMBL31436014 0.85 PTPN11 (0.43) PTPN11BRD4ATAD2PIK3CAMTOR
SCHEMBL31435930 0.85 PTPN11 (0.43) PTPN11BRD4PIK3CAMTORATM
SCHEMBL31435962 0.85 NTRK1 (0.47) PTPN11NTRK1CSF1RNTRK2KCNH2
SCHEMBL31435932 0.83 PTPN11 (0.43) PTPN11BRD4ATAD2PIK3CAMTOR

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 PTPN11 65/4885BRD4 2456/4885ATAD2 4420/4885

“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.