SCHEMBL13335092

SCHEMBL13335092

COC(=O)N(C)N(C)C(=O)c1cc(Br)cc(Br)c1NC(=O)c1cc(Cl)nn1-c1ncccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.35
▸ MALT1 Q9UDY8 11/20 0.33
▸ RBP4 P02753 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ LRRK2 Q5S007 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
SCHEMBL123506 0.93 DHODH (0.40) DHODHMALT1RBP4MEN1KMT2A
SCHEMBL29360347 0.93 DHODH (0.40) DHODHMALT1RBP4MEN1KMT2A
SCHEMBL29458550 0.93 DHODH (0.40) DHODHMALT1RBP4MEN1KMT2A
SCHEMBL10028779 0.90 ALDH1A1 (0.37) DHODHMALT1MEN1KMT2ALRRK2
SCHEMBL14960695 0.89 DHODH (0.33) DHODHMEN1KMT2ALRRK2
SCHEMBL13318643 0.86 MALT1 (0.33) DHODHMALT1RBP4LRRK2
SCHEMBL16908633 0.85 MALT1 (0.34) DHODHMALT1LRRK2
SCHEMBL31628519 0.85 DHODH (0.38) DHODHMALT1LRRK2
SCHEMBL326444 0.85 DHODH (0.38) DHODHMALT1LRRK2
SCHEMBL17750084 0.85 DHODH (0.39) DHODHMALT1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785646-B2 Process for producing amide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-07-22 — — US disclosed
US-8541613-B2 Process for producing amide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-09-24 — — US disclosed
US-8501951-B2 Process for producing amide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-08-06 — — US disclosed
US-20130131371-A1 PROCESS FOR PRODUCING AMIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-05-23 — — US disclosed
US-20130131348-A1 PROCESS FOR PRODUCING AMIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-05-23 — — US disclosed
US-20130131349-A1 PROCESS FOR PRODUCING AMIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-05-23 — — US disclosed
US-8394838-B2 Process for producing amide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-03-12 — — US disclosed
US-8394838-B2 Process for producing amide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-03-12 — — US disclosed
US-20100120866-A1 PROCESS FOR PRODUCING AMIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-13 — — US disclosed
US-20100120866-A1 PROCESS FOR PRODUCING AMIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-13 — — 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 (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-20100120866-A1 PROCESS FOR PRODUCING AMIDE COMPOUND C9, C5, F3 DHODH 2524/4885MALT1 4740/4885RBP4 2512/4885
US-20130131349-A1 PROCESS FOR PRODUCING AMIDE COMPOUND C9, F3, C5 DHODH 2693/4885MALT1 4710/4885RBP4 2618/4885
US-20130131371-A1 PROCESS FOR PRODUCING AMIDE COMPOUND C9, F3, C5 DHODH 2693/4885MALT1 4710/4885RBP4 2618/4885
US-20130131348-A1 PROCESS FOR PRODUCING AMIDE COMPOUND C9, F3, C5 DHODH 2693/4885MALT1 4710/4885RBP4 2618/4885

“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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