SCHEMBL13318578

SCHEMBL13318578

COC(=O)NNC(=O)c1cc(Br)cc(Br)c1N(C)C(=O)c1cc(Br)nn1-c1ncccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.38
▸ ALDH1A1 P00352 1/20 0.34
▸ MALT1 Q9UDY8 6/20 0.33
▸ ADAM17 P78536 2/20 0.31
▸ RBP4 P02753 1/20 0.31

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
SCHEMBL12911709 0.92 DHODH (0.37) DHODHMALT1ADAM17
SCHEMBL29181523 0.86 DHODH (0.36) DHODHALDH1A1MALT1
SCHEMBL950318 0.86 DHODH (0.36) DHODHALDH1A1MALT1
Hydrochloric Acid SCHEMBL29181525 0.85 DHODH (0.36) DHODHALDH1A1MALT1
SCHEMBL14494979 0.85 DHODH (0.36) DHODHMALT1
SCHEMBL31438693 0.84 DHODH (0.41) DHODHALDH1A1MALT1RBP4
SCHEMBL121385 0.84 DHODH (0.41) DHODHALDH1A1MALT1RBP4
SCHEMBL28459476 0.82 DHODH (0.38) DHODHMALT1RBP4
SCHEMBL28456798 0.82 DHODH (0.37) DHODHALDH1A1MALT1RBP4
SCHEMBL28447607 0.80 CHIA (0.39) DHODHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137314-A1 HARMFUL ORGANISM CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 — — US disclosed
US-20100137314-A1 HARMFUL ORGANISM CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 — — US disclosed
US-20100099692-A1 HARMFUL ORGANISM CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-22 — — US disclosed
US-20100099692-A1 HARMFUL ORGANISM CONTROL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-22 — — US disclosed
WO-2007043677-A9 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL CO (JP) 2007-06-07 — — 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 (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-20100099692-A1 HARMFUL ORGANISM CONTROL COMPOSITION UQCRC1, UQCRC2, Q6ZSR9 DHODH 277/4885ALDH1A1 280/4885MALT1 4850/4885
US-20100137314-A1 HARMFUL ORGANISM CONTROL COMPOSITION UQCRC2, UQCRC1, UQCRB DHODH 558/4885ALDH1A1 217/4885MALT1 4804/4885

“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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