SCHEMBL16221282

SCHEMBL16221282

Cc1ccccc1-c1c(S)cccc1-c1cccc(-c2ccc3c4ccccc4c4ccccc4c3c2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ TSHR P16473 4/20 0.35
▸ CYP2C19 P33261 4/20 0.35
▸ CLK4 Q9HAZ1 4/20 0.35
▸ CYP1A2 P05177 3/20 0.35
▸ CYP3A4 P08684 3/20 0.35
▸ CYP2D6 P10635 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34
▸ HTR1A P08908 1/20 0.33
▸ AR P10275 1/20 0.33
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ NMT2 O60551 1/20 0.33
▸ NMT1 P30419 1/20 0.33
▸ HIF1A Q16665 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
SCHEMBL17073387 0.96 TSHR (0.37) HTR7KDM4ETSHRCYP2C19CLK4
SCHEMBL25081631 0.89 KDM4E (0.35) HTR7KDM4EPRMT5WDR77CA12
SCHEMBL17641568 0.82 HTR7 (0.38) HTR7KDM4ETSHRCYP2C19CLK4
SCHEMBL16135169 0.81 KDM4E (0.33) HTR7KDM4ETSHRCYP2C19CLK4
SCHEMBL17536903 0.80 KDM4E (0.45) HTR7KDM4ETSHRCYP2C19CLK4
SCHEMBL18019644 0.79 CD274 (0.38) CA12CA1CA2CA9TRPA1
SCHEMBL16135103 0.79 HTR7 (0.35) HTR7KDM4ETSHRCYP2C19CLK4
SCHEMBL16135108 0.79 KDM4E (0.34) HTR7KDM4ECA12CA1CA2
SCHEMBL26575894 0.79 DPP4 (0.40) HTR7KDM4ETSHRCYP2C19CLK4
SCHEMBL17263371 0.78 KDM4E (0.39) HTR7KDM4ECYP2C19CYP1A2CYP3A4

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-9153786-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2015-10-06 — — US disclosed
US-20140326977-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2014-11-06 — — US disclosed
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