SCHEMBL18644262

SCHEMBL18644262

COCCOCCOc1ccc(-c2c(C)ccc(C)c2COCCOCCO)cc1C

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 1/20 0.39
OXTR P30559 1/20 0.39
AVPR1A P37288 1/20 0.39
S1PR1 P21453 4/20 0.39
HTR1A P08908 1/20 0.37
RARB P10826 1/20 0.35
TLR8 Q9NR97 1/20 0.35
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ESR1 P03372 2/20 0.32
ESR2 Q92731 2/20 0.32
HPGD P15428 1/20 0.32
CD274 Q9NZQ7 2/20 0.32
AR P10275 1/20 0.31

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
SCHEMBL18644245 1.00 AVPR2 (0.39) AVPR2OXTRAVPR1AS1PR1HTR1A
SCHEMBL18644265 0.83 HTR1A (0.40) AVPR2OXTRAVPR1AS1PR1HTR1A
SCHEMBL18644251 0.83 HTR1A (0.40) AVPR2OXTRAVPR1AS1PR1HTR1A
SCHEMBL15430851 0.81 HTR1A (0.34) HTR1AALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL18644254 0.81 OXTR (0.39) AVPR2OXTRAVPR1AS1PR1HTR1A
SCHEMBL18644249 0.78 RARB (0.43) AVPR2OXTRAVPR1AS1PR1HTR1A
SCHEMBL18644264 0.78 RARB (0.43) AVPR2OXTRAVPR1AS1PR1HTR1A
SCHEMBL18644250 0.78 AVPR2 (0.39) AVPR2OXTRAVPR1AS1PR1HTR1A
SCHEMBL18644244 0.77 HTR1A (0.39) AVPR2OXTRAVPR1AS1PR1HTR1A
SCHEMBL18644252 0.76 AVPR2 (0.38) AVPR2OXTRAVPR1AS1PR1HTR1A

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-9601696-B2 Electroluminescent composition and electric device with high brightness SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-03-21 US disclosed