SCHEMBL9843764

SCHEMBL9843764

CCCCc1nc(C)c(C(C)C)c(O)n1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCGR P47871 4/20 0.33
FFAR1 O14842 1/20 0.32
NPC1 O15118 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MAPT P10636 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
SCHEMBL9843680 0.78 NPC1 (0.34) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL8515583 0.77
SCHEMBL9843662 0.75 MAPT (0.37) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL9843881 0.75 MAPT (0.37) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL16460603 0.74
SCHEMBL2229077 0.70 LMNA (0.45) HPGDHTTMAPT
SCHEMBL28619888 0.68 POLB (0.45) HPGDHTTNPSR1
SCHEMBL28868241 0.68 LMNA (0.42) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL5587629 0.67 FFAR1 (0.46) GCGRFFAR1NPC1HPGDMAPK1
SCHEMBL12251371 0.67 CASP1 (0.41) MAPK1

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
EP-0407342-A2 Pyrimidine derivatives CIBA-GEIGY AG (CH) 1991-01-09 EP disclosed