SCHEMBL12912129

SCHEMBL12912129

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

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 1/20 0.33
▸ CYP17A1 P05093 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ SLC40A1 Q9NP59 1/20 0.33
▸ PARP1 P09874 1/20 0.31
▸ PARP4 Q9UKK3 1/20 0.31
▸ GCK P35557 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ TRPV1 Q8NER1 2/20 0.30
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CA P42336 1/20 0.30
▸ PIK3CB P42338 1/20 0.30
▸ PIK3CG P48736 1/20 0.30
▸ PBRM1 Q86U86 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
SCHEMBL950557 0.93 DHODH (0.33) DHODHCYP17A1CYP1A2POLBTRPV1
SCHEMBL12912130 0.91 DHODH (0.34) DHODHCYP17A1CYP1A2
SCHEMBL12528160 0.90 RAB9A (0.35) DHODHCYP17A1CYP1A2SLC40A1PARP1
SCHEMBL12528553 0.88 DHODH (0.35) DHODHCYP17A1CYP1A2SLC40A1PARP1
SCHEMBL12528168 0.88 DHODH (0.43) DHODHCYP17A1CYP1A2SLC40A1PARP1
SCHEMBL12528926 0.86 DHODH (0.33) DHODHCYP17A1CYP1A2SLC40A1PARP1
SCHEMBL12528180 0.85 CYP17A1 (0.37) DHODHCYP17A1CYP1A2SLC40A1PARP1
SCHEMBL12528591 0.85 DHODH (0.34) DHODHCYP17A1CYP1A2SLC40A1PIK3CD
SCHEMBL12528578 0.85 SLC40A1 (0.36) DHODHCYP17A1CYP1A2SLC40A1PIK3CD
SCHEMBL12528568 0.85 MEN1 (0.34) DHODHCYP17A1CYP1A2SLC40A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20090181956-A1 Hydrazide Compound and Pesticidal Use of the Same ACHE, DDT, CAT DHODH 284/4885CYP17A1 1452/4885CYP1A2 504/4885

“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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