SCHEMBL9769358

SCHEMBL9769358

CCCC(c1ccccc1)c1cccc(CC)c1CC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.42
SLC6A4 P31645 2/20 0.39
AOC3 Q16853 2/20 0.36
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
OPRL1 P41146 1/20 0.35
FFAR1 O14842 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
ADRB3 P13945 1/20 0.35
GABRA1 P14867 2/20 0.34
GABRB2 P47870 2/20 0.34
HRH1 P35367 3/20 0.34
HTR2A P28223 2/20 0.34

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
SCHEMBL1836152 0.81 HTT (0.39) HTTADRB2ADRB1ADRB3LMNA
SCHEMBL6547447 0.79 HTT (0.48) HTTSLC6A4OPRM1OPRD1OPRK1
SCHEMBL1842023 0.79 HTT (0.38) HTTPOLBLMNASMN1; SMN2
SCHEMBL21753488 0.78 HTT (0.47) HTTSLC6A4OPRM1OPRD1OPRK1
SCHEMBL1840249 0.78 NPC1 (0.38) HTTSIGMAR1LMNASMN1; SMN2
SCHEMBL1836545 0.77 HTT (0.41) HTTOPRM1OPRD1OPRK1OPRL1
SCHEMBL1838775 0.77 NPC1 (0.39) HTTLMNASMN1; SMN2
SCHEMBL1839547 0.77 NPC1 (0.39) HTTLMNASMN1; SMN2
SCHEMBL1843986 0.77 NPC1 (0.39) HTTLMNASMN1; SMN2
SCHEMBL1836102 0.77 NPC1 (0.39) HTTLMNASMN1; SMN2

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-4996537-A Method of and apparatus for recording image FUJI PHOTO FILM CO., LTD. (JP) 1991-02-26 US disclosed