SCHEMBL28978073

SCHEMBL28978073

Nc1cn(C2CCN(C(=O)OCc3ccccc3)CC2)nc1C(F)F

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.53
CYP2C19 P33261 1/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
GRIN2B Q13224 9/20 0.46
CYP2D6 P10635 4/20 0.45
CYP2C9 P11712 4/20 0.45
HTT P42858 1/20 0.44
CYP3A4 P08684 3/20 0.43
FAAH O00519 1/20 0.41
ENPP2 Q13822 1/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40

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
SCHEMBL28977994 0.84 SMN1; SMN2 (0.49) SMN1; SMN2CYP2C19NPC1RAB9AMEN1
SCHEMBL28978036 0.80 SMN1; SMN2 (0.55) SMN1; SMN2CYP2C19NPC1RAB9AMEN1
SCHEMBL30267127 0.80 KDM5A (0.41)
SCHEMBL27059331 0.78 SMN1; SMN2 (0.59) SMN1; SMN2CYP2C19NPC1RAB9AMEN1
SCHEMBL21997425 0.78 CTSD (0.43) NPC1RAB9AHTT
SCHEMBL15991264 0.74 SMN1; SMN2 (0.68) SMN1; SMN2CYP2C19NPC1RAB9AMEN1
SCHEMBL18368416 0.74 SMN1; SMN2 (0.59) SMN1; SMN2CYP2C19NPC1RAB9AMEN1
SCHEMBL2896415 0.73 SMN1; SMN2 (0.76) SMN1; SMN2CYP2C19NPC1RAB9AMEN1
SCHEMBL19732305 0.73 SMN1; SMN2 (0.57) SMN1; SMN2CYP2C19NPC1RAB9AMEN1
SCHEMBL19732433 0.73 SMN1; SMN2 (0.54) SMN1; SMN2CYP2C19NPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4709486-A1 HETEROARYL COMPOUNDS AS LIGAND DIRECTED DEGRADERS OF IRAK4 Celgene Corporation (US) 2026-03-18 EP disclosed
EP-4709389-A1 HETEROARYL COMPOUNDS AS LIGAND DIRECTED DEGRADERS OF IRAK4 Celgene Corporation (US) 2026-03-18 EP disclosed
WO-2024233747-A1 HETEROARYL COMPOUNDS AS LIGAND DIRECTED DEGRADERS OF IRAK4 CELGENE CORPORATION (US) 2024-11-14 WO disclosed
WO-2024233748-A1 HETEROARYL COMPOUNDS AS LIGAND DIRECTED DEGRADERS OF IRAK4 CELGENE CORPORATION (US) 2024-11-14 WO disclosed
CN-115710274-A IRAK4 degradation agent, preparation method and application thereof 上海领泰生物医药科技有限公司 2023-02-24 CN disclosed