SCHEMBL7555053

SCHEMBL7555053

CCN(C(=O)OC)c1c(C(=O)O)ccc(Br)c1OCC(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.35
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
KDM4E B2RXH2 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TAS2R14 Q9NYV8 2/20 0.31
SMN1; SMN2 Q16637 3/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
LMNA P02545 4/20 0.30
GAA P10253 2/20 0.30
NPSR1 Q6W5P4 2/20 0.30
MAPT P10636 2/20 0.30
RBP4 P02753 1/20 0.30
RXRA P19793 2/20 0.30
HNF4A P41235 1/20 0.30
MEN1 O00255 2/20 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
SCHEMBL7557820 0.87 HSD17B10 (0.40) HTTL3MBTL1ALDH1A1TSHRHSD17B10
SCHEMBL7557884 0.84 HSD17B10 (0.40) HTTL3MBTL1ALDH1A1TSHRHSD17B10
SCHEMBL7553289 0.84 HTT (0.33) HTTALDH1A1
SCHEMBL7555575 0.80 LMNA (0.32) KDM4EL3MBTL1ALDH1A1TSHRHSD17B10
SCHEMBL7556621 0.79 CNR2 (0.35) ALDH1A1
SCHEMBL7552003 0.78
SCHEMBL7552001 0.78
SCHEMBL7557946 0.77 TDP1 (0.38) HTTKDM4EL3MBTL1ALDH1A1TSHR
SCHEMBL7559576 0.75 SMN1; SMN2 (0.40) HTTCYP1A2CYP2C9KDM4EL3MBTL1
SCHEMBL5604030 0.75 L3MBTL1 (0.41) HTTCYP1A2CYP2C9KDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6369270-B1 CHEMICAL INTERMEDIATES RHONE POULENC AGRICULTURE LIMITED (GB) 2002-04-09 US claimed
EP-0734380-B1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES AVENTIS AGRICULTURE LTD (GB) 2002-07-10 EP disclosed
US-6369270-B1 CHEMICAL INTERMEDIATES RHONE POULENC AGRICULTURE LIMITED (GB) 2002-04-09 US disclosed
US-6114538-A 2-POSITION OF BENZOY RING OF 4-BENZOYLISOXAZOLE DERIVATIVE IS SUBSTITUTED AND PARTICULARLY USED AGAINST MONOCOTYLEDONOUS WEEDS BY POST-EMEREGENECE APPLICATION RHONE POULENC AGRICULTURE LIMITED (GB) 2000-09-05 US disclosed
US-5998653-A CHEMICAL INTERMEDIATE FOR HERBICIDES RHONE POULENC AGRICULTURE LIMITED (GB) 1999-12-07 US disclosed
US-5658858-A POSTEMERGENCE HERBICIDES RHONE-POULENC ARGRICULTURE LIMITED (GB) 1997-08-19 US disclosed
EP-0734380-A1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1996-10-02 EP disclosed
WO-1995016678-A1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LIMITED (GB) 1995-06-22 WO disclosed