SCHEMBL4052245

SCHEMBL4052245

NC(=O)N1CCc2ncsc2C1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.67
DRD2 P14416 6/20 0.44
DRD3 P35462 6/20 0.44
GRM5 P41594 8/20 0.42
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
RYR2 Q92736 1/20 0.33
FGFR1 P11362 1/20 0.32
FGFR2 P21802 1/20 0.32

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
SCHEMBL28474185 0.85 MAPK1 (0.68) MAPK1DRD2DRD3GRM5NPC1
SCHEMBL30513269 0.81 MAPK1 (0.63) MAPK1DRD2DRD3GRM5NPC1
SCHEMBL24576867 0.77 DRD2 (0.51) MAPK1DRD2DRD3GRM5
SCHEMBL30916184 0.77 MAPK1 (0.58) MAPK1GRM5
SCHEMBL741598 0.77 MAPK1 (0.58) MAPK1GRM5
SCHEMBL13413141 0.75 MAPK1 (0.59) MAPK1DRD2DRD3GRM5NPC1
SCHEMBL30513280 0.75 MAPK1 (0.55) MAPK1DRD2DRD3GRM5
SCHEMBL17613234 0.74 DRD2 (0.50) MAPK1DRD2DRD3GRM5FGFR1
SCHEMBL30861099 0.72 MAPK1 (0.52) MAPK1DRD2DRD3GRM5NPC1
SCHEMBL16765902 0.72 MEN1 (0.53) MAPK1DRD2DRD3GRM5NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049548-A1 FUSED OXAZOLES & THIAZOLES AS HISTAMINE H3- RECEPTOR LIGANDS UCB Pharma, S.A. (BE) 2009-04-22 EP claimed
WO-2008012010-A1 FUSED OXAZOLES & THIAZOLES AS HISTAMINE H3- RECEPTOR LIGANDS UCB PHARMA, S.A. (BE) 2008-01-31 WO claimed
CN-118019735-A Arylsulfonyl compounds as CCR6 inhibitors 坎莫森特里克斯公司 2024-05-10 CN disclosed