SCHEMBL31662870

SCHEMBL31662870

COc1cc(CN2C(=O)C(Cl)=C(Cl)C2O)ccc1N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.41
VEGFA P15692 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
TP53 P04637 2/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
SUV39H2 Q9H5I1 6/20 0.39
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
ALK Q9UM73 2/20 0.39
KDM1A O60341 2/20 0.38

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
SCHEMBL31662829 0.88 VEGFA (0.41) VEGFAEGLN1SMN1; SMN2TP53HTT
SCHEMBL31662853 0.88 MEN1 (0.42) NPSR1LMNA
SCHEMBL31663171 0.86 SMN1; SMN2 (0.41) P2RX7VEGFAEGLN1SMN1; SMN2TP53
SCHEMBL31662801 0.86 SMN1; SMN2 (0.53) VEGFAEGLN1SMN1; SMN2TP53HTT
SCHEMBL31662831 0.83 MC4R (0.38) TP53NPSR1LMNAMAPTDRD2
SCHEMBL31662817 0.81 GPR119 (0.50) VEGFAEGLN1SMN1; SMN2TP53
SCHEMBL31662878 0.79 SMN1; SMN2 (0.42) P2RX7VEGFAEGLN1SMN1; SMN2HTT
SCHEMBL31662840 0.77 SMN1; SMN2 (0.47) SMN1; SMN2TP53HTTNPSR1LMNA
SCHEMBL31662710 0.77 HSD17B10 (0.42) NPSR1LMNA
SCHEMBL31651670 0.76 DRD2 (0.54) SMN1; SMN2HTTNPSR1LMNAMAPT

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-2025147756-A1 VIRAL SENSITIZERS COMPOSITIONS, METHODS AND USES THEREOF OTTAWA HOSPITAL RESEARCH INSTITUTE (CA) 2025-07-17 WO disclosed