SCHEMBL6131303

SCHEMBL6131303

CCCc1cc(CCC)c(N)c(CCC)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.37
GABRB2 P47870 3/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
ALOX5 P09917 1/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
GFER P55789 1/20 0.35
DHFR P00374 2/20 0.35
POLB P06746 1/20 0.34
HTT P42858 1/20 0.34
CA2 P00918 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
NOS3 P29474 1/20 0.33
NOS1 P29475 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
SCHEMBL31614612 0.95 DHFR (0.35) GABRA1GABRB2GABRA5GABRA3GABRA2
SCHEMBL27876554 0.89 SKP2 (0.41) GABRA1GABRB2GABRA5GABRA3GABRA2
SCHEMBL14645233 0.89 GABRA1 (0.41) GABRA1GABRB2GABRA5GABRA3GABRA2
SCHEMBL11497456 0.88 HTT (0.47) GABRA1GABRB2GABRA5GABRA3GABRA2
SCHEMBL1100124 0.88 DHFR (0.41) DHFRPOLBHTTNOS3NOS1
SCHEMBL19972056 0.87 GABRA1 (0.34) GABRA1GABRB2GABRA5GABRA3GABRA2
SCHEMBL10933384 0.85 HTT (0.42) GABRA1GABRB2GABRA5GABRA3GABRA2
SCHEMBL5380950 0.82 DHFR (0.44) DHFRPOLBHTT
SCHEMBL9326441 0.82 ALDH1A1 (0.38) GABRA1GABRB2GABRA5GABRA3GABRA2
SCHEMBL6131314 0.81 SKP2 (0.47) GABRA1GABRB2GABRA5GABRA3GABRA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6927009-B2 Positive photosensitive composition FUJI PHOTO FILM CO., LTD. (JP) 2005-08-09 US disclosed
EP-1260864-B1 Positive photosensitive composition FUJI PHOTO FILM CO LTD (JP) 2004-08-18 EP disclosed
US-20030077540-A1 Positive photosensitive composition FUJI PHOTO FILM CO., LTD. 2003-04-24 US disclosed
EP-1260864-A1 Positive photosensitive composition FUJI PHOTO FILM CO., LTD. (JP) 2002-11-27 EP disclosed
US-4012222-A Herbicidal compositions containing dioxolane substituted anilids and method therefor VELSICOL CHEMICAL CORPORATION (US) 1977-03-15 US disclosed
US-3948950-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-04-06 US disclosed
US-3946045-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-03-23 US disclosed
US-3942972-A Dioxolane substituted α-haloanilides as herbicides VELSICOL CHEMICAL CORPORATION (US) 1976-03-09 US disclosed
US-3940259-A Dioxane substituted-α-haloanilides as herbicides VELSICOL CHEMICAL CORPORATION (US) 1976-02-24 US disclosed