SCHEMBL9870873

SCHEMBL9870873

[c]1c(Cc2ccccc2)cnc2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
CALM1 P0DP23 1/20 0.38
HPGDS O60760 1/20 0.36
PDE10A Q9Y233 1/20 0.36
GAA P10253 1/20 0.35
AOC3 Q16853 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
TAAR1 Q96RJ0 2/20 0.33
LTA4H P09960 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33

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
SCHEMBL5748976 0.78 PDE10A (0.38) ALDH1A1MAPTHPGDPDE10AGAA
SCHEMBL9871357 0.75 PDE10A (0.40) ALDH1A1MAPTHPGDPDE10AGAA
SCHEMBL9870472 0.72 TLR7 (0.41) ALDH1A1MAPTHPGDPDE10ANPC1
SCHEMBL28039436 0.71 KDM4E (0.41) ALDH1A1HPGDGAARAB9A
SCHEMBL5747831 0.70 TLR7 (0.48) ALDH1A1MAPTHPGDGAANPC1
SCHEMBL3992249 0.68 PDE10A (0.64) LMNAALDH1A1MAPTHPGDHTT
SCHEMBL852825 0.68 CALM1 (0.42) CALM1LTA4H
SCHEMBL9870917 0.68 NPC1 (0.39) LMNAALDH1A1MAPTHPGDHTT
SCHEMBL16289117 0.67 BCHE (0.40) LMNAALDH1A1MAPTHPGDHTT
SCHEMBL4365682 0.67 PDE10A (0.38) LMNAALDH1A1MAPTHPGDHTT

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
US-5051447-A Applying aromatic oximes to plants, seeds or soils BASF AKTIENGESELLSCHAFT (DE) 1991-09-24 US disclosed