SCHEMBL8850477

SCHEMBL8850477

COC(=O)c1c2cccccc-2cc1C(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.48
SRC P12931 1/20 0.48
FGFR2 P21802 1/20 0.48
FGFR4 P22455 1/20 0.48
FGFR3 P22607 1/20 0.48
HTT P42858 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
LMNA P02545 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
PRKCZ Q05513 1/20 0.46
GABRA1 P14867 2/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44

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
SCHEMBL6053412 0.79 HTT (0.54) FGFR1SRCFGFR2FGFR4FGFR3
SCHEMBL5270840 0.78 LMNA (0.49) FGFR1SRCFGFR2FGFR4FGFR3
SCHEMBL23479756 0.76 RAB9A (0.49) ALDH1A1GABRG2GABRB3GABRA5GABRA3
SCHEMBL13228930 0.76 HTT (0.62) FGFR1SRCFGFR2FGFR4FGFR3
SCHEMBL17469415 0.76 RAB9A (0.42) HTTLMNAALDH1A1HSD17B10
SCHEMBL28093762 0.74 CA12 (0.51) HTTLMNAMEN1ALDH1A1KMT2A
SCHEMBL7051555 0.73 SLC6A3 (0.58) HTTSLC6A2SLC6A4SLC6A3LMNA
SCHEMBL69682 0.72 SLC6A3 (0.57) FGFR1SRCFGFR2FGFR4FGFR3
SCHEMBL9049651 0.72 CA12 (0.69) FGFR1SRCFGFR2FGFR4FGFR3
SCHEMBL31019062 0.72 FGFR1 (0.57) FGFR1SRCFGFR2FGFR4FGFR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9077694-A None JP disclosed
JP-H0977694-A NEW PRODUCTION OF GUAIAZULENE OR ITS DERIVATIVE TAKASAGO INTERNATL CORP 1997-03-25 JP disclosed