SCHEMBL30698347

SCHEMBL30698347

COc1cc2ncc(-c3ccc(F)c(N[C@H]4CN(C(=O)OC(C)(C)C)CC[C@@H]4F)n3)n2nc1C(C)(C)O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 6/20 0.38
▸ DNMT3A Q9Y6K1 1/20 0.37
▸ CFTR P13569 4/20 0.37
▸ NTRK1 P04629 2/20 0.36
▸ NSD2 O96028 1/20 0.36
▸ PIK3CD O00329 1/20 0.35
▸ CCNT1 O60563 1/20 0.35
▸ CDK9 P50750 1/20 0.35
▸ TRPV3 Q8NET8 1/20 0.35
▸ PDE4B Q07343 1/20 0.34
▸ GPR119 Q8TDV5 1/20 0.34
▸ TNF P01375 1/20 0.34
▸ LITAF Q99732 1/20 0.34

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
SCHEMBL31000115 0.88 CFTR (0.40) ALKDNMT3ACFTRNSD2CCNT1
SCHEMBL31639293 0.83 TRPV3 (0.37) ALKDNMT3ANSD2CCNT1CDK9
SCHEMBL31739613 0.83 ALK (0.35) ALKDNMT3ACFTRNTRK1NSD2
SCHEMBL27327760 0.82 FLT3 (0.40) —
SCHEMBL27330374 0.82 FLT3 (0.40) —
SCHEMBL30716642 0.81 EIF2AK4 (0.38) NTRK1TRPV3GPR119
SCHEMBL30716643 0.81 EIF2AK4 (0.38) NTRK1TRPV3GPR119
SCHEMBL31739827 0.81 FLT3 (0.35) TNF
SCHEMBL27329570 0.81 FLT3 (0.35) TNF
SCHEMBL27327086 0.81 FLT3 (0.35) TNF

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 3 patents. 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
EP-4540248-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF Children's Hospital Medical Center (US) 2025-04-23 — — EP disclosed
WO-2023245123-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2023-12-21 — — WO 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 ALK 128/4885DNMT3A 27/4885CFTR 1381/4885

“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.

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