SCHEMBL10401680

SCHEMBL10401680

C[Si](C)(C)Cc1ccc2ccc(Cl)cc2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.43
PDE10A Q9Y233 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HRH3 Q9Y5N1 1/20 0.39
HTR3E A5X5Y0 1/20 0.38
HTR3B O95264 1/20 0.38
HTR3A P46098 1/20 0.38
HTR3D Q70Z44 1/20 0.38
HTR3C Q8WXA8 1/20 0.38
LMNA P02545 2/20 0.37
CYP1A2 P05177 1/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
POLB P06746 1/20 0.37
RXFP1 Q9HBX9 1/20 0.36
AR P10275 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL13878246 0.81 NR4A2 (0.46) NR4A2PDE10AMEN1KMT2AHRH3
SCHEMBL3276372 0.79 NR4A2 (0.47) NR4A2PDE10AKMT2AHRH3HTR3E
SCHEMBL14128956 0.78 PDE10A (0.49) NR4A2PDE10AMEN1KMT2AHTR3E
SCHEMBL1911781 0.77 NR4A2 (0.46) NR4A2PDE10AHRH3HTR3EHTR3B
SCHEMBL28887330 0.77 S1PR4 (0.49) NR4A2PDE10AHRH3HTR3EHTR3B
SCHEMBL29518426 0.77 CCR1 (0.48) NR4A2PDE10AHRH3HTR3EHTR3B
SCHEMBL7809623 0.77 S1PR4 (0.49) NR4A2PDE10AKMT2AHRH3HTR3E
SCHEMBL203068 0.77 CCR1 (0.48) NR4A2PDE10AHRH3HTR3EHTR3B
SCHEMBL4348088 0.77 LOXL2 (0.47) NR4A2PDE10AHRH3HTR3EHTR3B
SCHEMBL14094658 0.76 PDE10A (0.42) NR4A2PDE10AMEN1KMT2AHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4962203-A ANTIASTHMATIC, ANTIALLERGENIC, ANTIINFLAMMATORY AND CYTOPROTECTIVE AGENTS MERCK FROST CANADA, INC. (CA) 1990-10-09 US disclosed
EP-0206751-A2 2-Substituted quinolines, their preparation and use MERCK FROSST CANADA INC. (CA) 1986-12-30 EP disclosed