SCHEMBL2593887

SCHEMBL2593887

NC(=O)C1CC=CCC1C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 3/20 0.52
GAA P10253 2/20 0.48
EPHX1 P07099 2/20 0.39
POLB P06746 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
EGLN1 Q9GZT9 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
GABRR1 P24046 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ABAT P80404 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
SCHEMBL2674256 1.00 GRM4 (0.52) GRM4GAAEPHX1POLBTDP1
SCHEMBL7546291 0.89 GRM4 (0.46) GRM4GAAPOLBTDP1KDM4E
SCHEMBL7546288 0.89 GRM4 (0.46) GRM4GAAPOLBTDP1KDM4E
SCHEMBL7546289 0.89 GRM4 (0.46) GRM4GAAPOLBTDP1KDM4E
SCHEMBL13544795 0.87 GRM4 (0.49) GRM4GAAEPHX1POLBTDP1
SCHEMBL2674427 0.84 GRM4 (0.42) GRM4GAAEPHX1GABRR1ABAT
SCHEMBL2674257 0.84 GRM4 (0.42) GRM4GAAEPHX1GABRR1ABAT
SCHEMBL15772906 0.83 GRM4 (0.54) GRM4GAAPOLBTDP1KDM4E
SCHEMBL3505995 0.82 GRM4 (0.53) GRM4GAAPOLBTDP1KDM4E
SCHEMBL11330406 0.82 GRM4 (0.41) GRM4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993021762-A1 THE GEL STIMULATOR CONTAINING A FUNGICIDE WITH A BACTERIOSTATIC TO BACTERICIDAL EFFECT VONDRUS BOHUMIL (CZ) 1993-11-11 WO claimed
EP-0198202-B1 NOVEL N-CYCLOHEXYL-POLYCARBOXAMIDE COMPOUND AND DERIVATIVES THEREOF, PROCESSES FOR PREPARING THEM, AND USE OF THEM IN PREPARATION OF HOST-GUEST COMPLEXES MITSUBISHI CORPORATION (JP) 1991-07-17 EP claimed
EP-0216347-B1 A MODIFIED BLOCK COPOLYMER COMPOSITION Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1990-11-07 EP claimed
CN-115353481-A Catalytic synthesis method of cis-1, 2,3, 6-tetrahydrophthalimide 宁夏格瑞精细化工有限公司 2022-11-18 CN disclosed
EP-2563790-A1 A PROCESS OF A QUATERNARY AMMONIUM SALT Dainippon Sumitomo Pharma Co., Ltd. (JP) 2013-03-06 EP disclosed
EP-2563791-A1 A PROCESS OF A QUATERNARY AMMONIUM SALT USING PHOSPHATE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2013-03-06 EP disclosed
WO-2011136384-A1 A PROCESS OF A QUATERNARY AMMONIUM SALT USING PHOSPHATE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-11-03 WO disclosed
WO-2011136383-A1 A PROCESS OF A QUATERNARY AMMONIUM SALT DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-11-03 WO disclosed
WO-1993021762-A1 THE GEL STIMULATOR CONTAINING A FUNGICIDE WITH A BACTERIOSTATIC TO BACTERICIDAL EFFECT VONDRUS BOHUMIL (CZ) 1993-11-11 WO disclosed
EP-0085115-A1 MODIFIED BLOCK COPOLYMER COMPOSITION Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1983-08-10 EP disclosed