SCHEMBL12528396

SCHEMBL12528396

Cc1cc(I)c2nc(-c3cc(Br)nn3-c3ncccc3Cl)oc(=O)c2c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.42
▸ C1R P00736 2/20 0.33
▸ CYP17A1 P05093 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ PTK2B Q14289 1/20 0.30

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
SCHEMBL12528630 0.92 DHODH (0.42) DHODHC1RCYP17A1CYP1A2KDM4E
SCHEMBL12528224 0.91 C1R (0.34) DHODHC1RCYP17A1CYP1A2
SCHEMBL950558 0.91 DHODH (0.41) DHODHCYP17A1CYP1A2KDM4EMEN1
SCHEMBL12528168 0.91 DHODH (0.43) DHODHCYP17A1CYP1A2KDM4EMEN1
SCHEMBL951320 0.91 DHODH (0.40) DHODHC1R
SCHEMBL30466603 0.88 DHODH (0.44) DHODHC1RCYP17A1CYP1A2
SCHEMBL959396 0.88 DHODH (0.44) DHODHC1RCYP17A1CYP1A2
SCHEMBL12911989 0.88 DHODH (0.40) DHODHKDM4EMEN1ALDH1A1POLB
SCHEMBL12528358 0.87 DHODH (0.41) DHODHKDM4EALDH1A1
SCHEMBL12911874 0.87 KDM4E (0.33) DHODHC1RKDM4EMEN1ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968573-B2 Hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-28 — — US disclosed
US-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME IKEGAMI HIROSHI 2011-03-24 — — US disclosed
US-7867949-B2 Hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-11 — — US disclosed
US-20090181956-A1 Hydrazide Compound and Pesticidal Use of the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-07-16 — — US 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-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME ACHE, H1-2, H1-0 DHODH 771/4885C1R 1132/4885CYP17A1 2438/4885
US-20090181956-A1 Hydrazide Compound and Pesticidal Use of the Same ACHE, DDT, CAT DHODH 284/4885C1R 4485/4885CYP17A1 1452/4885

“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.

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