SCHEMBL27369865

SCHEMBL27369865

FC1CCNCC1Nc1cccc(-c2cnc3cnccn23)n1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 14/20 0.58
FLT3 P36888 11/20 0.52
IRAK1 P51617 5/20 0.51
NRAS P01111 4/20 0.51
LCK P06239 3/20 0.48
RET P07949 3/20 0.48
PDGFRB P09619 3/20 0.48
CDK7 P50613 3/20 0.48
CCNH P51946 3/20 0.48
BLK P51451 2/20 0.48
SRPK1 Q96SB4 1/20 0.47
MAPK8 P45983 1/20 0.46

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
SCHEMBL24573998 1.00 IRAK4 (0.58) IRAK4FLT3IRAK1NRASLCK
SCHEMBL27369262 0.91 FLT3 (0.57) IRAK4FLT3IRAK1NRASLCK
SCHEMBL24574349 0.91 FLT3 (0.57) IRAK4FLT3IRAK1NRASLCK
SCHEMBL29748695 0.87 IRAK4 (0.77) IRAK4FLT3IRAK1NRASLCK
SCHEMBL24574513 0.87 IRAK4 (0.77) IRAK4FLT3IRAK1NRASLCK
SCHEMBL24574001 0.84 FLT3 (0.56) IRAK4FLT3IRAK1NRASLCK
SCHEMBL27369869 0.84 FLT3 (0.56) IRAK4FLT3IRAK1NRASLCK
SCHEMBL24574118 0.83 IRAK4 (0.78) IRAK4FLT3IRAK1NRASLCK
SCHEMBL27370282 0.83 IRAK4 (0.78) IRAK4FLT3IRAK1NRASLCK
SCHEMBL24574146 0.82 FLT3 (0.57) IRAK4FLT3IRAK1NRASLCK

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
WO-2023250431-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2023-12-28 WO disclosed