SCHEMBL31739697

SCHEMBL31739697

COc1cc2ncc(-c3nc(N[C@H]4CNC[C@@H]4F)c(C)cc3C)n2nc1C1CC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NRAS P01111 5/20 0.36
▸ FLT3 P36888 5/20 0.36
▸ FYN P06241 2/20 0.30
▸ LCK P06239 1/20 0.30
▸ RET P07949 1/20 0.30
▸ PDGFRB P09619 1/20 0.30
▸ CDK7 P50613 1/20 0.30
▸ IRAK1 P51617 1/20 0.30
▸ CCNH P51946 1/20 0.30
▸ IRAK4 Q9NWZ3 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
SCHEMBL27329389 1.00 NRAS (0.36) NRASFLT3FYNLCKRET
SCHEMBL27326929 1.00 NRAS (0.36) NRASFLT3FYNLCKRET
SCHEMBL27330018 0.93 FLT3 (0.40) NRASFLT3FYNLCKRET
SCHEMBL27327395 0.93 FLT3 (0.40) NRASFLT3FYNLCKRET
SCHEMBL27198235 0.91 NRAS (0.45) NRASFLT3FYNLCKRET
SCHEMBL27331195 0.91 NRAS (0.45) NRASFLT3FYNLCKRET
SCHEMBL27326933 0.89 FLT3 (0.41) NRASFLT3FYNLCKRET
SCHEMBL27329396 0.89 FLT3 (0.41) NRASFLT3FYNLCKRET
SCHEMBL31739830 0.88 FLT3 (0.41) NRASFLT3FYNLCKRET
SCHEMBL27326930 0.88 FLT3 (0.41) NRASFLT3FYNLCKRET

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-20250368648-A1 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2025-12-04 — — 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-20250368648-A1 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF FLT3, IRAK1, IRAK2 NRAS 371/4885FLT3 1/4885FYN 181/4885

“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.

Send feedback