SCHEMBL8008435

SCHEMBL8008435

C=COC(C)(CC)CCCCC

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
FDPS P14324 11/20 0.32
GGPS1 O95749 7/20 0.32
SMPD1 P17405 4/20 0.32
ALDH1A1 P00352 1/20 0.31
CES2 O00748 1/20 0.31
LPAR1 Q92633 1/20 0.31
LPAR3 Q9UBY5 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
SCHEMBL28185127 0.94 TSHR (0.32) TSHRALDH1A1
SCHEMBL20176701 0.81 TSHR (0.30) TSHR
SCHEMBL4403474 0.80 MEN1 (0.44)
SCHEMBL3035858 0.79 TDP1 (0.37) TSHRFDPSGGPS1SMPD1LPAR1
SCHEMBL8008433 0.77 TSHR (0.39) TSHRFDPSGGPS1SMPD1CES2
SCHEMBL9112677 0.77 TSHR (0.39) TSHRFDPSGGPS1SMPD1CES2
SCHEMBL9004671 0.77 TSHR (0.39) TSHRFDPSGGPS1SMPD1CES2
SCHEMBL18675764 0.75 TSHR (0.38) TSHRFDPSGGPS1SMPD1CES2
SCHEMBL18682927 0.75
SCHEMBL28143365 0.74 TSHR (0.36) TSHRFDPSGGPS1SMPD1ALDH1A1

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-6103449-A ALKALI-SOLUBLE RESIN WITH REPEATING UNITS FROM NORBORNENE SKELETON-CONTAINING MONOMERS; PHOTOACID GENERATOR; COMPOUND WHICH LOWERS SOLUBILITY OF RESIN IN PRESENCE OF ACID; FOR EXPOSURE TO FAR ULTRAVIOLET RADIATION FUJI PHOTO FILM CO., LTD. (JP) 2000-08-15 US disclosed