SCHEMBL19206977

SCHEMBL19206977

CCCCCCCCCCCCc1cc2c3cc(CCCCCCCCCCCC)c4cc([Sn](C)(C)C)sc4c3ccc2c2sc([Sn](C)(C)C)cc12

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.36
LIPG Q9Y5X9 4/20 0.36
TYR P14679 2/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX5 P09917 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TLR8 Q9NR97 5/20 0.33
LPL P06858 3/20 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
SCHEMBL16322529 0.77 GPR35 (0.38) GPR35LIPGALOX5
SCHEMBL320889 0.77 GPR35 (0.38) GPR35LIPGALOX5
SCHEMBL2398006 0.77 GPR35 (0.38) GPR35LIPGALOX5
SCHEMBL321731 0.76 GPR35 (0.40) GPR35LIPGALOX5
SCHEMBL12821692 0.75 GPR35 (0.32) GPR35
SCHEMBL15572259 0.75 GPR35 (0.40) GPR35LIPGTYRMEN1TP53
SCHEMBL16039801 0.75 GPR35 (0.40) GPR35LIPGTYRMEN1TP53
SCHEMBL19206982 0.74 TLR8 (0.33) GPR35LIPGTYRMEN1TP53
SCHEMBL23668753 0.74 GPR35 (0.60) GPR35LIPGTYRMEN1TP53
SCHEMBL27963937 0.73 GPR35 (0.39) GPR35LIPGTYRMEN1TP53

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
US-10074804-B2 Picene derivative, photoelectric material, and photoelectric device ADEKA CORPORATION (JP) 2018-09-11 US disclosed
EP-3210986-A1 PICENE DERIVATIVE, PHOTOELECTRIC CONVERSION MATERIAL AND PHOTOELECTRIC CONVERSION ELEMENT Adeka Corporation (JP) 2017-08-30 EP disclosed
US-20170237011-A1 PICENE DERIVATIVE, PHOTOELECTRIC MATERIAL, AND PHOTOELECTRIC DEVICE ADEKA CORPORATION (JP) 2017-08-17 US disclosed