SCHEMBL148344

SCHEMBL148344

O=C(Nc1ncn[nH]1)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALPL P05186 10/20 0.68
F2 P00734 1/20 0.68
NPC1 O15118 4/20 0.68
RAB9A P51151 2/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
KDM4E B2RXH2 1/20 0.65
POLB P06746 1/20 0.65
SIRT2 Q8IXJ6 1/20 0.63
ALPI P09923 1/20 0.61
ALPG P10696 1/20 0.61
L3MBTL1 Q9Y468 2/20 0.60
LMNA P02545 1/20 0.57
MAPT P10636 1/20 0.57
KMT2A Q03164 1/20 0.57
ALOX15 P16050 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP2C9 P11712 1/20 0.57
TSHR P16473 1/20 0.57

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
SCHEMBL9371060 0.88 EPHX1 (0.56) ALPLF2NPC1RAB9ASMN1; SMN2
SCHEMBL146921 0.83 ALPL (0.60) ALPLF2NPC1RAB9ASMN1; SMN2
SCHEMBL26704088 0.81 ALPL (1.00) ALPLF2NPC1RAB9ASMN1; SMN2
SCHEMBL2555021 0.79 ALPL (1.00) ALPLF2NPC1RAB9ASMN1; SMN2
SCHEMBL29349711 0.79 ALPL (1.00) ALPLF2NPC1RAB9ASMN1; SMN2
SCHEMBL26073569 0.78 L3MBTL1 (0.70) ALPLF2NPC1RAB9ASMN1; SMN2
SCHEMBL6337970 0.75 ALPL (0.69) ALPLF2NPC1RAB9ASMN1; SMN2
SCHEMBL3901691 0.74 ALPL (0.63) ALPLF2NPC1RAB9ASMN1; SMN2
SCHEMBL2490949 0.74 ALPL (0.51) ALPLF2NPC1RAB9ASMN1; SMN2
SCHEMBL151398 0.72 NPC1 (0.50) F2NPC1RAB9ASMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108349912-B Substituted ketoxime benzamides 拜耳作物科学股份公司 2021-06-08 CN disclosed
US-10785979-B2 Substituted ketoxime benzoylamides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-09-29 US disclosed
US-10779540-B2 Benzamide compounds and their use as herbicides BASF SE (DE) 2020-09-22 US disclosed
EP-3390372-B1 BENZAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2020-06-03 EP disclosed
EP-3341363-B1 SUBSTITUTED KETOXIME BENZOYLAMIDE BAYER CROPSCIENCE AG (DE) 2019-07-24 EP disclosed
EP-3390372-A1 BENZAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2018-10-24 EP disclosed
US-20180235224-A1 SUBSTITUTED KETOXIME BENZOYLAMIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-08-23 US disclosed
EP-2855463-B1 SUBSTITUTED N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)ARYLCARBOXAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2018-08-01 EP disclosed
EP-3341363-A1 SUBSTITUTED KETOXIME BENZOYLAMIDES Bayer CropScience Aktiengesellschaft (DE) 2018-07-04 EP disclosed
US-9902704-B2 Substituted N-(tetrazol-5-yl)- and N-(triazol-5-yl)arylcarboxamide compounds and their use as herbicides BASF SE (DE) 2018-02-27 US disclosed
WO-2013076316-A2 SUBSTITUTED N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)HETARYLCARBOXAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2013-05-30 WO disclosed
WO-2013076315-A2 SUBSTITUTED N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)ARYLCARBOXAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2013-05-30 WO disclosed
WO-2013072528-A2 SUBSTITUTED N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)PYRIDIN-3-YL-CARBOXAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2013-05-23 WO disclosed
WO-2013064457-A1 5-PHENYL-SUBSTITUTED N-(TETRAZOL-5-YL) ARYL CARBOXYLIC ACID AMIDES AND N-(TRIAZOL-5-YL) ARYL CARBOXYLIC ACID AMIDES, AND USE THEREOF AS HERBICIDES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-05-10 WO disclosed
WO-2013064459-A1 HERBICIDALLY ACTIVE OXIME-ETHER-SUBSTITUTED BENZOYLAMIDES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-05-10 WO disclosed
EP-2589598-A1 5-phenyl substituted N-(Tetrazol-5-yl)- and N-(Triazol-5-yl)aryl carboxylic acid amides and use of same as herbicides Bayer CropScience AG (DE) 2013-05-08 EP disclosed
WO-2013017559-A1 N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)ARYLCARBOXAMIDES AND USE THEREOF AS HERBICIDES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-02-07 WO disclosed
WO-2012123409-A1 N-(1,2,5-OXADIAZOL-3-YL)-, N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)BICYCLOARYLCARBOXAMIDES AND THEIR USE AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2012-09-20 WO disclosed
US-20120058892-A1 N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)ARYLCARBOXAMIDES AND THEIR USE AS HERBICIDES BAYER CROPSCIENCE AG (US) 2012-03-08 US disclosed
WO-2012028579-A1 N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)ARYLCARBOXAMIDES AND USE THEREOF AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2012-03-08 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 (4 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-20120058892-A1 N-(TETRAZOL-5-YL)- AND N-(TRIAZOL-5-YL)ARYLCARBOXAMIDES AND THEIR USE AS HERBICIDES ZYX, NAT1, CYCS ALPL 1665/4885F2 3439/4885NPC1 4393/4885
US-10779540-B2 Benzamide compounds and their use as herbicides DDT, DNPH1, BBOX1 ALPL 2459/4885F2 4448/4885NPC1 3946/4885
US-10785979-B2 Substituted ketoxime benzoylamides KYAT3, KMO, OXA1L ALPL 3373/4885F2 1803/4885NPC1 4850/4885
US-20180235224-A1 SUBSTITUTED KETOXIME BENZOYLAMIDES KYAT3, KMO, OXA1L ALPL 3373/4885F2 1803/4885NPC1 4850/4885

“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.