SCHEMBL9854901

SCHEMBL9854901

c1cnc(C2CCO2)nc1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.38
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 2/20 0.31
GAA P10253 1/20 0.31
HRH1 P35367 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
Fluoride SCHEMBL28071051 1.00 MAPK1 (0.38) MAPK1POLBMAPTKDM4EGAA
SCHEMBL5930198 0.89 HRH1 (0.40) MAPK1POLBMAPTKDM4EGAA
SCHEMBL23774708 0.87 PDE8B (0.36) MAPK1POLBMAPTKDM4EGAA
SCHEMBL10375163 0.79
SCHEMBL7784164 0.78 MAPK1 (0.33) MAPK1
SCHEMBL7356983 0.76
SCHEMBL4616657 0.75 MAPK1 (0.34) MAPK1
SCHEMBL28865518 0.74 MAPK8 (0.30)
SCHEMBL913262 0.74 DRD2 (0.46)
Hydrogen Sulfide SCHEMBL28070942 0.73 DRD2 (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4698524-A1 TRIARYL AGONISTS OF ALPHA-2 ADRENERGIC RECEPTORS Alceptor Therapeutics, Inc. (US) 2026-02-25 EP disclosed
WO-2024220941-A1 TRIARYL AGONISTS OF ALPHA-2 ADRENERGIC RECEPTORS ALCEPTOR THERAPEUTICS, INC. (US) 2024-10-24 WO disclosed
CN-110461842-A FUSED PENTACYCLIC IMIDAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL 2019-11-15 CN disclosed
EP-0433898-A2 Analogs of oxetanyl purines and pyrimidines ABBOTT LABORATORIES (US) 1991-06-26 EP disclosed