SCHEMBL8583585

SCHEMBL8583585

CC[C](CC)CC(C)(CC)CC

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL463159 0.73 TSHR (0.38) TSHRTDP1
SCHEMBL8359740 0.71 TSHR (0.30) TSHRTDP1
SCHEMBL11922855 0.69 TSHR (0.33) TSHRTDP1
SCHEMBL4655335 0.67 TSHR (0.38) TSHRTDP1
SCHEMBL1419066 0.67 HMGCR (0.52) TSHRTDP1
SCHEMBL27647738 0.67 TSHR (0.41) TSHRTDP1
SCHEMBL28172056 0.67
SCHEMBL17933420 0.67 ALDH1A1 (0.42) TSHRTDP1
SCHEMBL134136 0.67
SCHEMBL17129998 0.65 TDP1 (0.47) TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998031697-A1 ARYL C-GLYCOSIDE COMPOUNDS AND SULFATED ESTERS THEREOF SANKYO COMPANY, LIMITED (JP) 1998-07-23 WO disclosed
EP-0280650-B1 USE OF PREDETERMINED BENZTRIAZOLE DERIVATIVES AS LIGHT-PROTECTING AGENTS FOR INK JET RECORDING MATERIALS CIBA-GEIGY AG (CH) 1992-04-08 EP disclosed
WO-1991000276-A1 BIPYRIDYLES, PROCESS FOR MAKING THEM AND THEIR USE RIEDEL-DE HAEN AKTIENGESELLSCHAFT (DE) 1991-01-10 WO disclosed
US-4926190-A EMULSIONS CIBA-GEIGY CORPORATION (US) 1990-05-15 US disclosed
EP-0280650-A1 Use of predetermined benztriazole derivatives as light-protecting agents for ink jet recording materials CIBA-GEIGY AG (CH) 1988-08-31 EP disclosed