SCHEMBL8700617

SCHEMBL8700617

CCCc1ccccc1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 3/20 0.41
ADRA2B P18089 3/20 0.41
ADRA2C P18825 3/20 0.41
HTR1A P08908 2/20 0.41
NISCH Q9Y2I1 1/20 0.41
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
AR P10275 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
LTB4R Q15722 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
PPARD Q03181 1/20 0.36
CSNK1A1 P48729 1/20 0.35
CSNK1D P48730 1/20 0.35
PRKCD Q05655 1/20 0.35
PAK1 Q13153 1/20 0.35
CAMK2B Q13554 1/20 0.35
CAMK2G Q13555 1/20 0.35
CAMK2D Q13557 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
SCHEMBL19812300 0.86 TAAR1 (0.37) HTR1ATAAR1RIPK1NPSR1MEN1
SCHEMBL9853837 0.86 L3MBTL1 (0.44) ADRA2AADRA2BADRA2CNISCHSLC6A2
SCHEMBL388941 0.85 TAAR1 (0.56) TAAR1
SCHEMBL7438547 0.85 NPSR1 (0.36) TAAR1RIPK1NPSR1
SCHEMBL19812305 0.83 L3MBTL1 (0.40) TAAR1CSNK1A1CSNK1DPRKCDPAK1
SCHEMBL16113242 0.83 TAAR1 (0.35) TAAR1CSNK1A1CSNK1DPRKCDPAK1
SCHEMBL7240943 0.82 RIPK1 (0.36) TAAR1RIPK1
SCHEMBL2325955 0.82 RIPK1 (0.36) TAAR1RIPK1
SCHEMBL15283292 0.82 RIPK1 (0.36) TAAR1RIPK1NPSR1
SCHEMBL2675279 0.82 ELANE (0.38) TAAR1RIPK1NPSR1

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-5827868-A Prostaglandin analogs E. R. SQUIBB & SONS, INC. (US) 1998-10-27 US disclosed