SCHEMBL11304563

SCHEMBL11304563

C[Si](C)(C)Oc1cccc2[nH]ccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 4/20 0.50
HTR1B P28222 2/20 0.48
TRPA1 O75762 1/20 0.47
HTR1A P08908 7/20 0.46
AHR P35869 1/20 0.46
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
LMNA P02545 2/20 0.43
ADRB2 P07550 2/20 0.43
ADRB1 P08588 2/20 0.43
ADRB3 P13945 2/20 0.43
MAPK1 P28482 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
DRD4 P21917 2/20 0.43
DRD3 P35462 2/20 0.43
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43
CYP2D6 P10635 1/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL3034603 0.83 RHEB (0.45) RHEBHTR1BTRPA1HTR1AAHR
SCHEMBL29992666 0.83 RHEB (0.45) RHEBHTR1BTRPA1HTR1AAHR
SCHEMBL2087774 0.81 HTR1B (0.51) RHEBHTR1BTRPA1HTR1AAHR
SCHEMBL30681623 0.80 AHR (0.57) RHEBHTR1BTRPA1HTR1AAHR
SCHEMBL29992707 0.79 RHEB (0.54) RHEBHTR1BTRPA1HTR1AAHR
SCHEMBL321761 0.79 RHEB (0.54) RHEBHTR1BTRPA1HTR1AAHR
SCHEMBL29445066 0.79 RHEB (0.54) RHEBHTR1BTRPA1HTR1AAHR
SCHEMBL1499400 0.78 RHEB (0.73) RHEBHTR1BTRPA1HTR1AAHR
Ethane SCHEMBL7616752 0.77 RHEB (0.53) RHEBHTR1BTRPA1HTR1AAHR
Ethyne SCHEMBL28266951 0.76 RHEB (0.51) RHEBHTR1BTRPA1HTR1AAHR

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
JP-56140970-A None JP disclosed
JP-56167668-A None JP disclosed
JP-S56167668-A PREPARATION OF INDOLE DERIVATIVE RONZA CHEM:KK 1981-12-23 JP disclosed
JP-S56140970-A PREPARATION OF INDOLE DERIVATIVE RONZA CHEM:KK 1981-11-04 JP disclosed