SCHEMBL26087673

SCHEMBL26087673

O=C(O)N1OCC[C@H]1c1cccc(F)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 3/20 0.49
PDE5A O76074 1/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
SCD5 Q86SK9 4/20 0.40
PKM P14618 1/20 0.40
NPC1 O15118 1/20 0.40
MAOB P27338 2/20 0.39
MAOA P21397 1/20 0.39
JAK2 O60674 1/20 0.38
NTRK1 P04629 1/20 0.38
DRD4 P21917 1/20 0.37
PIK3C3 Q8NEB9 2/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL29730037 1.00 RIPK1 (0.49) RIPK1PDE5AKDM4EALDH1A1SCD5
SCHEMBL26087676 1.00 RIPK1 (0.49) RIPK1PDE5AKDM4EALDH1A1SCD5
SCHEMBL22444793 1.00 RIPK1 (0.49) RIPK1PDE5AKDM4EALDH1A1SCD5
SCHEMBL27169375 0.87 RIPK1 (0.40) RIPK1KDM4EALDH1A1SCD5DRD4
SCHEMBL27040854 0.87 RIPK1 (0.40) RIPK1KDM4EALDH1A1SCD5DRD4
SCHEMBL25202993 0.85 RIPK1 (0.50) RIPK1KDM4EALDH1A1
SCHEMBL28459091 0.85 RIPK1 (0.50) RIPK1KDM4EALDH1A1
SCHEMBL20580700 0.84 RIPK1 (0.64) RIPK1PDE5AKDM4EALDH1A1PKM
SCHEMBL18921372 0.84 RIPK1 (0.64) RIPK1PDE5AKDM4EALDH1A1PKM
SCHEMBL22210923 0.84 RIPK1 (0.64) RIPK1PDE5AKDM4EALDH1A1PKM

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-2023068881-A1 ARYL OR HETEROARYL DERIVATIVE, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF KINASE-RELATED DISEASES 주식회사 보로노이바이오 2023-04-27 WO disclosed