SCHEMBL6915088

SCHEMBL6915088

CC(NC(=O)c1c(C)cccc1C)=C1C=CCC(=C(C)NC(=O)c2c(C)cccc2C)N1.CC(NC(=O)c1c(C)cccc1C)=C1C=CCC(=C(C)NC(=O)c2c(C)cccc2C)N1.[Nd].[Nd]c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 10/20 0.34
L3MBTL1 Q9Y468 1/20 0.32
NSD2 O96028 1/20 0.31
SLC6A5 Q9Y345 1/20 0.30
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
TAS1R2 Q8TE23 1/20 0.30

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
Hydrochloric Acid SCHEMBL6907187 0.90 SLC6A9 (0.33) SLC6A9L3MBTL1TAS1R3TAS1R1TAS1R2
Fluoride Ion SCHEMBL6915194 0.90 SLC6A9 (0.32) SLC6A9L3MBTL1TAS1R3TAS1R1TAS1R2
SCHEMBL6912535 0.89 SLC6A9 (0.33) SLC6A9
Alcohol SCHEMBL6911143 0.89 F2R (0.33) SLC6A9L3MBTL1TAS1R3TAS1R1TAS1R2
SCHEMBL6912820 0.88 F2R (0.33) SLC6A9
SCHEMBL6911371 0.85 TAS1R3 (0.32) SLC6A9TAS1R3TAS1R1TAS1R2
SCHEMBL6915058 0.72
SCHEMBL7196800 0.70 GRIN2D (0.37) L3MBTL1
SCHEMBL7196802 0.70 GRIN2D (0.37) L3MBTL1
SCHEMBL6910788 0.61 LMNA (0.34)

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
WO-2004074333-A2 PROCESS FOR HOMO- OR COPOLYMERIZATIONOF CONJUGATED OLEFINES DOW GLOBAL TECHNOLOGIES INC. (US) 2004-09-02 WO disclosed