SCHEMBL30698334

SCHEMBL30698334

COc1cc2nc(-c3nc(Br)c(F)cc3F)cn2nc1C1CC1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SMN1; SMN2 Q16637 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
SCHEMBL31639175 0.77 NRAS (0.36) —
SCHEMBL31000313 0.77 SUV39H2 (0.33) —
SCHEMBL31639341 0.76 PDE10A (0.34) KDM4EALDH1A1MAPT
SCHEMBL30632316 0.76 JUND (0.34) KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL31639455 0.75 — —
SCHEMBL30852973 0.71 ACVR2A (0.38) KDM4ENPC1ALDH1A1LMNAMAPT
SCHEMBL31639411 0.71 NRAS (0.31) —
SCHEMBL31000272 0.71 PDE4B (0.34) MAPT
SCHEMBL31639231 0.70 HPGD (0.34) KDM4EALDH1A1MAPT
SCHEMBL31000296 0.69 PDE4B (0.36) NPC1ALDH1A1MAPTRAB9A

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
WO-2025137567-A1 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2025-06-26 — — WO 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
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