SCHEMBL22145804

SCHEMBL22145804

c1cc(NC2CCCNC2)nc(-c2cnc3ccccn23)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 12/20 1.00
FLT3 P36888 11/20 0.80
IRAK1 P51617 2/20 0.73
LCK P06239 1/20 0.73
RET P07949 1/20 0.73
PDGFRB P09619 1/20 0.73
CDK7 P50613 1/20 0.73
BLK P51451 1/20 0.73
CCNH P51946 1/20 0.73
SRPK1 Q96SB4 1/20 0.73
NRAS P01111 5/20 0.64

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
SCHEMBL22145801 0.94 IRAK4 (1.00) IRAK4FLT3IRAK1LCKRET
SCHEMBL19900082 0.89 FLT3 (1.00) IRAK4FLT3IRAK1NRAS
SCHEMBL376279 0.88 IRAK4 (0.79) IRAK4FLT3IRAK1LCKRET
SCHEMBL384845 0.88 IRAK4 (0.79) IRAK4FLT3IRAK1LCKRET
SCHEMBL24606332 0.88 IRAK4 (0.80) IRAK4FLT3IRAK1LCKRET
SCHEMBL27370282 0.88 IRAK4 (0.78) IRAK4FLT3IRAK1LCKRET
SCHEMBL24574118 0.88 IRAK4 (0.78) IRAK4FLT3IRAK1LCKRET
SCHEMBL18427792 0.87 IRAK4 (1.00) IRAK4FLT3IRAK1LCKRET
SCHEMBL19900101 0.85 FLT3 (1.00) IRAK4FLT3IRAK1LCKRET
SCHEMBL25988670 0.84 IRAK4 (0.72) IRAK4FLT3IRAK1LCKRET

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11542261-B2 Substituted Imidazo[1,2-a]-pyridines as IRAK 1/4 and FLT3 inhibitors CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2023-01-03 US disclosed
US-20220213094-A1 Substituted Imidazo[l,2-a]-pyridines as IRAK 1/4 and FLT3 Inhibitors CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2022-07-07 US disclosed
US-11254667-B2 Substituted imidazo[1,2-A]pyridines as IRAK 1/4 and flt3 inhibitors CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2022-02-22 US disclosed
EP-3500571-B1 IMIDAZO[1,2-A]PYRIDIN COMPOUNDS, COMPOSITIONS COMPRISING THEM, METHODS FOR TREATING DISEASES USING THEM, AND METHODS FOR PREPARING THEM CHILDRENS HOSPITAL MED CT (US) 2020-12-30 EP disclosed
US-20200270242-A1 COMPOUNDS, COMPOSITIONS, METHODS FOR TREATING DISEASES, AND METHODS FOR PREPARING COMPOUNDS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2020-08-27 US disclosed
US-20200199123-A1 COMPOUNDS, COMPOSITIONS, METHODS FOR TREATING DISEASES, AND METHODS FOR PREPARING COMPOUNDS CHILDRENS HOSPITAL MED CT (US) 2020-06-25 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 (5 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-20200199123-A1 COMPOUNDS, COMPOSITIONS, METHODS FOR TREATING DISEASES, AND METHODS FOR PREPARING COMPOUNDS IRAK1, IRAK2, IRAK3 IRAK4 4/4885FLT3 63/4885IRAK1 1/4885
US-11254667-B2 Substituted imidazo[1,2-A]pyridines as IRAK 1/4 and flt3 inhibitors IRAK1, IRAK4, FLT3 IRAK4 2/4885FLT3 3/4885IRAK1 1/4885
US-20220213094-A1 Substituted Imidazo[l,2-a]-pyridines as IRAK 1/4 and FLT3 Inhibitors IRAK1, IRAK4, FLT3 IRAK4 2/4885FLT3 3/4885IRAK1 1/4885
US-20200270242-A1 COMPOUNDS, COMPOSITIONS, METHODS FOR TREATING DISEASES, AND METHODS FOR PREPARING COMPOUNDS VHL, ETV6, C5 IRAK4 1906/4885FLT3 549/4885IRAK1 1164/4885
US-11542261-B2 Substituted Imidazo[1,2-a]-pyridines as IRAK 1/4 and FLT3 inhibitors IRAK1, IRAK4, IRAK2 IRAK4 2/4885FLT3 5/4885IRAK1 1/4885

“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.