SCHEMBL20044948

SCHEMBL20044948

CCCCCC1Cc2cc(F)c3c4c(cc(F)c(c24)C1)CC(CCCCC)C3

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.39
HCAR2 Q8TDS4 3/20 0.37
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 2/20 0.33
CYP2C8 P10632 2/20 0.33
S1PR3 Q99500 2/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31
HTR1D P28221 2/20 0.30
HTR1B P28222 2/20 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
SCHEMBL7062160 0.79 FYN (0.38) FYNHCAR2CYP1A2CYP3A4CYP2C8
SCHEMBL7062989 0.79 CYP3A4 (0.37) FYNHCAR2CYP1A2CYP3A4CYP2C8
SCHEMBL7061221 0.78 CYP3A4 (0.39) FYNHCAR2CYP3A4CYP2C8S1PR3
SCHEMBL7064617 0.76 FYN (0.36) FYNHCAR2CYP1A2CYP3A4CYP2C8
SCHEMBL7061245 0.73 RARB (0.41) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL6683130 0.73 CYP3A4 (0.33) FYNHCAR2CYP1A2CYP3A4CYP2C8
SCHEMBL14590329 0.72 FYN (0.43) FYNCYP1A2CYP3A4CYP2C8S1PR3
SCHEMBL12718678 0.70 FYN (0.75) FYNCYP1A2CYP3A4CYP2C8S1PR3
SCHEMBL7060962 0.70 CYP3A4 (0.36) HCAR2CYP3A4CYP2C8S1PR3CYP2D6
SCHEMBL9391229 0.70 CYP1A2 (0.37) FYNCYP1A2CYP3A4CYP2C8S1PR3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3319136-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING SAME FUJI-FILM Corporation (JP) 2018-05-09 EP disclosed
US-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed
US-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed