SCHEMBL31293650

SCHEMBL31293650

Cn1ccn2ncc(C(=O)N3CC4(CC(NC(=O)Nc5cc(C(F)(F)F)ccn5)C4)C3)c12

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.41
EPHX2 P34913 1/20 0.36
BTK Q06187 2/20 0.35
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
KDR P35968 1/20 0.35

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
SCHEMBL31293944 0.89 KDR (0.37) EPHX2KDR
SCHEMBL31293970 0.87 HCRTR2 (0.35) EPHX2HCRTR1HCRTR2
SCHEMBL31293559 0.87 USP30 (0.44) SYKBTKHCRTR1HCRTR2
SCHEMBL31293908 0.87 WNT1 (0.33) EPHX2KDR
SCHEMBL31293760 0.87 SYK (0.40) SYKBTK
SCHEMBL31293777 0.86 MAPK1 (0.36) BTK
SCHEMBL31293845 0.86 EPHX2 (0.48) EPHX2
SCHEMBL31293632 0.86 SMARCA2 (0.39) KDR
SCHEMBL31293481 0.86 CXCR3 (0.41) EPHX2KDR
SCHEMBL31293483 0.85 SYK (0.35) SYKHCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4724439-A1 HETEROARYL DERIVATIVES AS DDRS INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2026-04-15 EP claimed
WO-2024251855-A1 HETEROARYL DERIVATIVES AS DDRS INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2024-12-12 WO claimed