SCHEMBL1024586

SCHEMBL1024586

O=C(c1ccccc1)c1cnoc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
ATM Q13315 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
SRD5A2 P31213 1/20 0.48
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 5/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 1/20 0.42
MAPK13 O15264 1/20 0.42
MAPK12 P53778 1/20 0.42
MAPK11 Q15759 1/20 0.42
MAPK14 Q16539 1/20 0.42
NPC1 O15118 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HPGD P15428 2/20 0.41
PBRM1 Q86U86 1/20 0.41

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
SCHEMBL8811109 0.82 RAB9A (0.66) ALDH1A1KMT2AMEN1L3MBTL1HTT
SCHEMBL5163561 0.82 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1TDP1HTT
SCHEMBL22672415 0.78 LIG1 (0.53) ALDH1A1KMT2AMEN1HTTRAB9A
Benzophenone SCHEMBL5032137 0.75 ALDH1A1 (0.88) ALDH1A1KMT2AMEN1ATMTDP1
Benzophenone SCHEMBL3677415 0.75 ALDH1A1 (0.88) ALDH1A1KMT2AMEN1ATMTDP1
Benzophenone SCHEMBL30536983 0.75 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1ATMTDP1
Benzophenone SCHEMBL30537001 0.75 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1ATMTDP1
Benzophenone SCHEMBL28491203 0.75 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1ATMTDP1
Benzophenone SCHEMBL6061130 0.75 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1ATMTDP1
Benzophenone SCHEMBL1074283 0.75 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1ATMTDP1

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 460 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1148784-B1 WEED CONTROL BAYER AGRICULTURE LTD (GB) 2005-02-23 EP claimed
US-6713434-B2 CONTROL OF WEEDS USING A SYNERGISTIC MIXTURE OF A UREA HERBICIDE AND EITHER A 4-BENZOYLISOXAZOLE OR A 2-CYANO-1,3-DIONE HERBICIDE; FOR EXAMPLE, TEBUTHIURON AND ISOXAFLUTOLE ON CEREAL OR SUGAR CANE CROPS RHONE-POULENC AGRO (FR) 2004-03-30 US claimed
EP-1032267-B1 METHOD OF CONTROLLING WEEDS IN TRANSGENIC CROPS BAYER CROPSCIENCE SA (FR) 2004-03-10 EP claimed
US-20030060368-A1 Control of weeds using a synergistic mixture of a urea herbicide and either a 4-benzoylisoxazole or a 2-cyano-1,3-dione herbicide; for example, tebuthiuron and isoxaflutole on cereal or sugar cane crops MILLET JEAN-CLAUDE (FR) 2003-03-27 US claimed
CN-1093537-C Process for preparing composition contg. 4 -benzoyl-iso-oxazole derivs. PHONE POULENC AGRICULTURE LTD (GB) 2002-10-30 CN claimed
EP-0609798-B1 4-Benzoyl isoxazoles and their use as herbicides AVENTIS AGRICULTURE LTD (GB) 2002-10-02 EP claimed
EP-0734380-B1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES AVENTIS AGRICULTURE LTD (GB) 2002-07-10 EP claimed
US-20020045551-A1 4-benzoyl isoxazoles derivatives and their use as herbicides MUSIL TIBOR (GB) 2002-04-18 US claimed
CN-1079641-C Herbicidal compositions of 4-benzoylisoxazole or 2-cyano-1, 3-dione herbicides and antidotes therefor ZENECA LTD (GB) 2002-02-27 CN claimed
US-6323155-B1 EXCELLENT LEVEL OF HERBICIDAL ACTIVITY TOGETHER WITH CROP TOLERANCE RHONE-POULENC AGRICULTURE LIMITED (GB) 2001-11-27 US claimed
EP-0580439-A1 Benzoylisoxazoles and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1994-01-26 EP claimed
EP-0560482-A1 4-Benzoyl isoxazoles derivatives and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1993-09-15 EP claimed
EP-0560483-A1 4 Benzopyl isoxazole derivatives and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1993-09-15 EP claimed
CN-1076194-A Weedicide RHONE POULENC AGRICULTURE (GB) 1993-09-15 CN claimed
CN-1069267-A HERBICIDE RHONE POULENC AGRICULTURE (GB) 1993-02-24 CN claimed
CN-1069268-A Novel herbicide RHONE POULENC AGRICULTURE (GB) 1993-02-24 CN claimed
EP-0527037-A1 4-Benzoylisoxazole derivatives and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1993-02-10 EP claimed
EP-0527036-A1 4-Benzoylisoxazole derivatives and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1993-02-10 EP claimed
CN-1061596-A 4-Benzoylisoxazole Derivatives RHONE POULENC AGRICULTURE (GB) 1992-06-03 CN claimed
EP-0487357-A1 4 Benzoyl isoxazole derivatives RHONE-POULENC AGRICULTURE LTD. (GB) 1992-05-27 EP claimed

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

For each of this compound's patents that has machine-readable text (2 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-20030060368-A1 Control of weeds using a synergistic mixture of a urea herbicide and either a 4-benzoylisoxazole or a 2-cyano-1,3-dione herbicide; for example, tebuthiuron and isoxaflutole on cereal or sugar cane crops WEE1, GYS1, NOTUM ALDH1A1 1532/4885KMT2A 2578/4885MEN1 4630/4885
US-20020045551-A1 4-benzoyl isoxazoles derivatives and their use as herbicides CBR3, CBR1, GLRA3 ALDH1A1 2037/4885KMT2A 3499/4885MEN1 4809/4885

“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.