SCHEMBL7550765

SCHEMBL7550765

CN(c1cc(Br)ccc1C(=O)CC(=O)C1CC1)S(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.36
KMT2A Q03164 1/20 0.36
CYP19A1 P11511 2/20 0.35
CYP3A4 P08684 1/20 0.34
AAK1 Q2M2I8 1/20 0.34
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
TYK2 P29597 1/20 0.33
TSHR P16473 2/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 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
SCHEMBL7552268 0.86 TYK2 (0.43) L3MBTL1KMT2ACYP19A1CYP3A4AAK1
SCHEMBL7556685 0.85 L3MBTL1 (0.36) L3MBTL1KMT2ACYP19A1CYP3A4AAK1
SCHEMBL7579505 0.85 TYK2 (0.42) L3MBTL1KMT2AALDH1A1POLBTYK2
SCHEMBL7554628 0.82 TYK2 (0.45) KMT2AALDH1A1POLBTYK2MAPT
SCHEMBL8754760 0.82 HSD17B10 (0.35) L3MBTL1KMT2AALDH1A1POLBTSHR
SCHEMBL7690635 0.81 CYP3A4 (0.40) L3MBTL1KMT2ACYP3A4AAK1ALDH1A1
SCHEMBL7551560 0.80 KMT2A (0.38) L3MBTL1KMT2A
SCHEMBL7872381 0.77 NPC1 (0.40) L3MBTL1KMT2ACYP3A4AAK1ALDH1A1
SCHEMBL8813464 0.76 HPGD (0.42) KMT2ACYP3A4ALDH1A1POLBMAPT
SCHEMBL7557135 0.76 KDM4E (0.42) L3MBTL1KMT2ACYP19A1ALDH1A1POLB

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
EP-0352042-B1 High rigidity and impact resistance resin composition UBE INDUSTRIES (JP) 1995-03-29 EP claimed
EP-0734380-B1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES AVENTIS AGRICULTURE LTD (GB) 2002-07-10 EP disclosed
US-20020045551-A1 4-benzoyl isoxazoles derivatives and their use as herbicides MUSIL TIBOR (GB) 2002-04-18 US disclosed
US-6369270-B1 CHEMICAL INTERMEDIATES RHONE POULENC AGRICULTURE LIMITED (GB) 2002-04-09 US disclosed
US-6323155-B1 EXCELLENT LEVEL OF HERBICIDAL ACTIVITY TOGETHER WITH CROP TOLERANCE RHONE-POULENC AGRICULTURE LIMITED (GB) 2001-11-27 US disclosed
US-5998653-A CHEMICAL INTERMEDIATE FOR HERBICIDES RHONE POULENC AGRICULTURE LIMITED (GB) 1999-12-07 US disclosed
EP-0674629-B1 4-BENZOYL ISOXAZOLES DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE (GB) 1998-07-08 EP 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020045551-A1 4-benzoyl isoxazoles derivatives and their use as herbicides CBR3, CBR1, GLRA3 L3MBTL1 2099/4885KMT2A 3499/4885CYP19A1 1257/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.