SCHEMBL9769910

SCHEMBL9769910

CC(C)(C)c1cccc([C]c2cccc(C(C)(C)C)c2C(C)(C)C)c1C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.44
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KIF11 P52732 1/20 0.33
ALOX12 P18054 1/20 0.32
NAMPT P43490 1/20 0.32
NPSR1 Q6W5P4 1/20 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
SCHEMBL13209347 0.87 CA2 (0.41) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL1697185 0.83 CA2 (0.46) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL634438 0.83 CA2 (0.41) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL304569 0.80 CA2 (0.57) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL28564278 0.77 NPC1 (0.44) CA2ALDH1A1TSHRTDP1
SCHEMBL13525505 0.74 AR (0.47) CA2
SCHEMBL11572403 0.73 CA2 (0.50) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL4461655 0.73 CA2 (0.50) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL20143843 0.71 TSHR (0.46) CA2ALDH1A1TSHRKIF11NAMPT
SCHEMBL301235 0.71 CA2 (0.48) CA2GABRA1GABRB2ALDH1A1TSHR

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
US-5028516-A Method of forming an image comprising rapidly developing an infrared sensitized photographic material comprising surfactants FUJI PHOTO FILM CO., LTD. (JP) 1991-07-02 US claimed
US-5028516-A Method of forming an image comprising rapidly developing an infrared sensitized photographic material comprising surfactants FUJI PHOTO FILM CO., LTD. (JP) 1991-07-02 US disclosed