SCHEMBL7107435

SCHEMBL7107435

CC(C)=CC(C#N)NC(=O)c1cn(C)nc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.50
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
RAB9A P51151 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
ALPL P05186 1/20 0.44
CYP2C19 P33261 1/20 0.44
CTSV O60911 1/20 0.44
CTSL P07711 1/20 0.44
CTSS P25774 1/20 0.44
CTSK P43235 1/20 0.44
MAPT P10636 3/20 0.43
ATM Q13315 1/20 0.41
NAMPT P43490 1/20 0.41
NPC1 O15118 2/20 0.38
POLB P06746 1/20 0.34
USP2 O75604 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL10665843 0.90 GAA (0.45) GAAALDH1A1SMN1; SMN2RAB9ACYP1A2
SCHEMBL10665846 0.90 GAA (0.45) GAAALDH1A1SMN1; SMN2RAB9ACYP1A2
SCHEMBL10662035 0.83 GAA (0.34) GAAALDH1A1SMN1; SMN2RAB9ACYP1A2
SCHEMBL10664140 0.74 CTSL (0.44) GAAALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL16643752 0.74 GAA (0.55) GAAALDH1A1SMN1; SMN2RAB9ACYP1A2
SCHEMBL10705514 0.73 CTSS (0.50) GAAALDH1A1SMN1; SMN2RAB9ACYP1A2
SCHEMBL10338336 0.71 L3MBTL1 (0.43) GAAALDH1A1SMN1; SMN2RAB9ACYP1A2
SCHEMBL10665838 0.71 CTSV (0.46) GAAALDH1A1SMN1; SMN2RAB9ACYP1A2
SCHEMBL10703343 0.70 CTSV (0.45) GAAALDH1A1SMN1; SMN2RAB9ACYP1A2
SCHEMBL10662597 0.70 CTSV (0.45) GAAALDH1A1SMN1; SMN2RAB9ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63045264-A None JP disclosed
JP-2062802-A None JP disclosed
US-20030087958-A1 Hydrazine oxoacetamide derivative and insecticide AGRO-KANESHO CO., LTD. (JP) 2003-05-08 US disclosed
US-6399542-B1 INSECTICIDES; PESTICIDES AGRO-KANESHO CO., LTD. (JP) 2002-06-04 US disclosed
US-6399659-B2 EFFECTIVE AT LOW CONCENTRATIONS AGRO-KANESHO CO., LTD. (JP) 2002-06-04 US disclosed
US-20010044464-A1 Hydrazine oxoacetamide derivative and insecticide AGRO-KANESHO CO., LTD. (JP) 2001-11-22 US disclosed
US-6291399-B1 Agent for controlling diseases and insect pests, containing alkoxyimino-substituted bicyclic derivative as active ingredient AGRO-KANESHO CO., LTD. (JP) 2001-09-18 US disclosed
EP-1123920-A1 HYDRAZINOOXOACETAMIDE DERIVATIVES AND INSECTICIDE Agro-Kanesho Co. Ltd. (JP) 2001-08-16 EP disclosed
EP-1000928-A1 DISEASE OR INSECT PEST CONTROL AGENT CONTAINING ALKOXYIMINO-SUBSTITUTED BICYCLIC DERIVATIVE AS ACTIVE INGREDIENT Agro-Kanesho Company Limited (JP) 2000-05-17 EP disclosed
EP-0498396-B1 N-phenylcarbamate compound, process for preparing the same and biocidal composition for control of harmful organisms ISHIHARA SANGYO KAISHA (JP) 1997-07-16 EP disclosed
US-5436267-A An O-(N-2-carbamylphenyl)-heterocyclic oxime; insecticides; fungicides; miticides; nematocides; plant growth regulators; herbicides; viricides; attractants ISHIHARA SANGYO KAISHA, LTD. (JP) 1995-07-25 US disclosed
WO-1995011226-A1 SUBSTITUTED BENZENE DERIVATIVES, PROCESSES FOR THEIR PRODUCTION AND BIOCIDAL COMPOSITION FOR CONTROL OF HARMFUL ORGANISMS CONTAINING THEM ISHIHARA SANGYO KAISHA LTD. (JP) 1995-04-27 WO disclosed
US-5360806-A Insecticides ISHIHARA SANGYO KAISHA LTD. (JP) 1994-11-01 US disclosed
EP-0580374-A1 Pyridine amides and their salts, processes for their production and pesticidal compositions containing them ISHIHARA SANGYO KAISHA, LTD. (JP) 1994-01-26 EP disclosed
EP-0498396-A2 N-phenylcarbamate compound, process for preparing the same and biocidal composition for control of harmful organisms ISHIHARA SANGYO KAISHA, Ltd. (JP) 1992-08-12 EP disclosed
JP-H0262802-A GERMICIDAL COMPOSITION FOR AGRICULTURE AND HORTICULTURE MITSUI TOATSU CHEM INC 1990-03-02 JP disclosed
EP-0337103-A2 Biocidal composition ISHIHARA SANGYO KAISHA, Ltd. (JP) 1989-10-18 EP disclosed
US-4792565-A Pyrazolecarbonylamine derivatives and agricultural and horticultural fungicides containing said compounds MITSUI TOATSU CHEMICALS, INC. (JP) 1988-12-20 US disclosed
JP-S6345264-A NOVEL PYRAZOLE DERIVATIVE, PRODUCTION THEREOF AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE CONTAINING SAME MITSUI TOATSU CHEM INC 1988-02-26 JP disclosed
JP-H00262802-A 0001-01-01 JP 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 (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-20030087958-A1 Hydrazine oxoacetamide derivative and insecticide DDT, CYP2E1, HCN1 GAA 4830/4885ALDH1A1 596/4885SMN1; SMN2 3704/4885
US-20010044464-A1 Hydrazine oxoacetamide derivative and insecticide DDT, CYP2E1, HCN1 GAA 4830/4885ALDH1A1 596/4885SMN1; SMN2 3704/4885

“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.