SCHEMBL7552702

SCHEMBL7552702

CCOC(=O)N(CC)c1c(C(=O)O)ccc(Cl)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 3/20 0.37
KMT2A Q03164 3/20 0.37
TSHR P16473 3/20 0.37
HPGD P15428 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
MAPT P10636 2/20 0.34
POLB P06746 1/20 0.34
MAPK1 P28482 2/20 0.34
HTT P42858 2/20 0.34
METTL3 Q86U44 1/20 0.34
CLCN2 P51788 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 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
SCHEMBL7552028 0.89 TP53 (0.36) SLC6A2SLC6A4TP53ALDH1A1KMT2A
SCHEMBL7552749 0.89 CYP4F2 (0.45) SLC6A2SLC6A4ALDH1A1KMT2ATSHR
SCHEMBL7552802 0.87 TP53 (0.38) SLC6A2SLC6A4TP53ALDH1A1KMT2A
SCHEMBL7557094 0.87 KMT2A (0.41) TP53ALDH1A1KMT2ATSHRHPGD
SCHEMBL7553091 0.84 LMNA (0.41) SLC6A2SLC6A4ALDH1A1KMT2ATSHR
SCHEMBL7553749 0.84 TP53 (0.36) SLC6A2SLC6A4TP53ALDH1A1KMT2A
SCHEMBL7551788 0.82 CYP4F2 (0.41) SLC6A2SLC6A4ALDH1A1KMT2ATSHR
SCHEMBL7552228 0.81 CYP4F2 (0.43) SLC6A2SLC6A4TP53ALDH1A1KMT2A
SCHEMBL7555025 0.80 TSHR (0.43) TP53ALDH1A1KMT2ATSHRHPGD
SCHEMBL7550331 0.80 SLC6A4 (0.39) SLC6A2SLC6A4TP53ALDH1A1KMT2A

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