SCHEMBL31293845

SCHEMBL31293845

Cn1ccn2ncc(C(=O)N3CC4(CC(NC(=O)Nc5cccc(C(F)(F)F)c5)C4)C3)c12

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.48
DCUN1D1 Q96GG9 11/20 0.45
UBE2M P61081 9/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CCKBR P32239 2/20 0.41
MAPT P10636 1/20 0.40
XBP1 P17861 1/20 0.40
HTT P42858 1/20 0.40
CDK8 P49336 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
SCHEMBL31293582 0.94 EPHX2 (0.41) EPHX2DCUN1D1UBE2MMEN1KMT2A
SCHEMBL31293823 0.91 DCUN1D1 (0.50) EPHX2DCUN1D1UBE2MMEN1KMT2A
SCHEMBL31293571 0.89 EPHX2 (0.35) EPHX2DCUN1D1UBE2MMEN1KMT2A
SCHEMBL31293831 0.89 USP2 (0.44) EPHX2MEN1KMT2ACCKBRMAPT
SCHEMBL31293752 0.89 EPHX2 (0.44) EPHX2DCUN1D1UBE2MMEN1KMT2A
SCHEMBL31293599 0.89 CXCR3 (0.40) EPHX2
SCHEMBL31293540 0.88 EPHX2 (0.45) EPHX2DCUN1D1UBE2MMEN1KMT2A
SCHEMBL31294025 0.88 SMN1; SMN2 (0.36) EPHX2DCUN1D1UBE2MMEN1KMT2A
SCHEMBL31293745 0.88 UBE2M (0.44) EPHX2DCUN1D1UBE2MMEN1KMT2A
SCHEMBL31293632 0.87 SMARCA2 (0.39)

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