SCHEMBL7523013

SCHEMBL7523013

C=CCc1ccc(O)c(C(=NO)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.54
XDH P47989 1/20 0.50
KMT2A Q03164 5/20 0.49
GABRA1 P14867 5/20 0.49
GABRB2 P47870 5/20 0.49
MEN1 O00255 4/20 0.49
GAA P10253 3/20 0.49
CNR2 P34972 3/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
CNR1 P21554 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH2 P05091 1/20 0.49
AKR1B1 P15121 1/20 0.49
HPGD P15428 1/20 0.49
PPARG P37231 1/20 0.49
PPARD Q03181 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
ALOX5 P09917 4/20 0.43
CYP3A4 P08684 2/20 0.43

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
SCHEMBL5424638 0.88 XDH (0.59) MGLLXDHKMT2AGABRA1GABRB2
SCHEMBL27638863 0.81 KMT2A (0.41) MGLLXDHKMT2AGABRA1GABRB2
SCHEMBL8519932 0.76 XDH (0.56) MGLLXDHKMT2AGABRA1GABRB2
SCHEMBL5897101 0.74 KAT8 (0.60) MGLL
SCHEMBL20597302 0.74 KAT8 (0.60) MGLL
SCHEMBL3834574 0.74 KAT8 (0.60) MGLL
SCHEMBL28028748 0.74 KAT8 (0.60) MGLL
SCHEMBL18059943 0.74 KAT8 (0.60) MGLL
SCHEMBL28288244 0.74 KAT8 (0.60) MGLL
SCHEMBL5831390 0.73 XDH (0.61) XDHKMT2AGABRA1GABRB2MEN1

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
EP-1115891-A4 PROCESS FOR EXTRACTING AND RECOVERING COPPER COGNIS CORP (US) 2002-07-03 EP claimed
EP-1115891-A1 PROCESS FOR EXTRACTING AND RECOVERING COPPER Cognis Corporation (US) 2001-07-18 EP claimed
US-6210647-B1 EXTRACTANT IS PREFERABLY AN OXIME EXTRACTANT, EITHER A KETOXIME OR AN ALDOXIME. HENKEL CORPORATION 2001-04-03 US claimed
US-6177055-B1 WATER SOLUTIONS WITH COPPER STRIPPING SOLUTION WHEREBY COPPER VALUES ARE STRIPPED FROM THE ORGANIC PHASE INTO THE AQUEOUS ACIDIC STRIPPING SOLUTION; HENKEL CORPORATION 2001-01-23 US claimed
WO-2000015857-A1 PROCESS FOR EXTRACTING AND RECOVERING COPPER COGNIS CORPORATION (US) 2000-03-23 WO claimed
EP-0958390-A4 IMPROVEMENT IN THE PROCESS OF RECOVERY OF METALS HENKEL CORP (US) 2000-03-08 EP claimed
EP-0958390-A1 IMPROVEMENT IN THE PROCESS OF RECOVERY OF METALS HENKEL CORPORATION (US) 1999-11-24 EP claimed
WO-1998028454-A1 IMPROVEMENT IN THE PROCESS OF RECOVERY OF METALS HENKEL CORPORATION (US) 1998-07-02 WO claimed
US-3981966-A CONTACTING WITH CALCIUM OXIDE, AMMONIA E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-09-21 US disclosed