SCHEMBL7550720

SCHEMBL7550720

CCN(c1c(C(=O)O)ccc(F)c1F)S(C)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
HSD17B10 Q99714 3/20 0.36
ALDH1A1 P00352 2/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
POLB P06746 1/20 0.34
MCOLN3 Q8TDD5 1/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
KMT2A Q03164 4/20 0.33
MAPK1 P28482 2/20 0.33
TSHR P16473 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
MEN1 O00255 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL7552814 0.86 LMNA (0.40) LMNAHSD17B10ALDH1A1POLBMCOLN3
SCHEMBL7552041 0.83 LMNA (0.38) LMNAHSD17B10ALDH1A1POLBKMT2A
SCHEMBL7557970 0.83 TSHR (0.41) LMNAHSD17B10ALDH1A1POLBMCOLN3
SCHEMBL7558454 0.80 CES2 (0.39) LMNAHSD17B10ALDH1A1CES2CES1
SCHEMBL7554604 0.79 LMNA (0.35) LMNAALDH1A1POLBMCOLN3KMT2A
SCHEMBL7638566 0.77 LMNA (0.42) LMNAHSD17B10ALDH1A1KMT2AMAPK1
SCHEMBL7552015 0.77 HSD17B10 (0.36) LMNAHSD17B10ALDH1A1POLBKMT2A
SCHEMBL7554512 0.73 MAPK1 (0.45) LMNAHSD17B10ALDH1A1KMT2AMAPK1
SCHEMBL7554663 0.73 LMNA (0.44) LMNAHSD17B10ALDH1A1POLBMCOLN3
SCHEMBL7558771 0.73 BRAF (0.33) LMNA

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
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
CN-1137271-A 4-benzoylisoxazoles and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1996-12-04 CN 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