SCHEMBL6120929

SCHEMBL6120929

Cc1cc(Cl)cc(C(=O)N(C)NC(=O)O)c1NC(=O)c1cc(Br)nn1-c1ncccc1Cl

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.43
▸ MALT1 Q9UDY8 4/20 0.35
▸ KMT2A Q03164 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ NTRK1 P04629 3/20 0.31
▸ TRPV1 Q8NER1 1/20 0.30
▸ PSD A5PKW4 1/20 0.30
▸ SORT1 Q99523 1/20 0.30
▸ DRD4 P21917 1/20 0.30
▸ F10 P00742 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
SCHEMBL12559352 0.94 DHODH (0.41) DHODHMALT1TRPV1PSD
SCHEMBL13318598 0.94 DHODH (0.40) DHODHMALT1KMT2AMEN1NTRK1
SCHEMBL121150 0.93 DHODH (0.40) DHODHMALT1
SCHEMBL29735411 0.93 DHODH (0.40) DHODHMALT1
SCHEMBL951424 0.92 DHODH (0.42) DHODHMALT1TRPV1PSDDRD4
SCHEMBL13072533 0.92 DHODH (0.40) DHODHMALT1F10
SCHEMBL12528592 0.91 DHODH (0.43) DHODHMALT1KMT2AMEN1NTRK1
SCHEMBL951174 0.91 DHODH (0.43) DHODHMALT1NTRK1TRPV1PSD
SCHEMBL13726746 0.90 DHODH (0.41) DHODHMALT1KMT2A
SCHEMBL13073078 0.90 DHODH (0.40) DHODHMALT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3300602-B1 PESTICIDAL MIXTURES COMPRISING A PYRAZOLE COMPOUND BASF SE (DE) 2020-03-25 — — EP claimed
EP-3010889-B1 ARYLSULFIDE AND ARYLSULFOXIDE DERIVATIVES AS ACARICIDES AND INSECTICIDES BAYER CROPSCIENCE AG (DE) 2018-10-03 — — EP claimed
EP-2925142-B1 COMPOSITION COMPRISING A BIOLOGICAL CONTROL AGENT AND AN INSECTICIDE BAYER CROPSCIENCE AG (DE) 2018-01-31 — — EP claimed
EP-3319943-B1 NITROGEN-CONTAINING HETEROCYCLES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2019-06-26 — — EP disclosed
EP-2640706-A1 N-ARYL PYRAZOLE(THIO)CARBOXAMIDES Bayer Intellectual Property GmbH (DE) 2013-09-25 — — EP disclosed
CN-102686573-A Fluorinated oxa or thia heteroarylalkylsulfide derivatives for combating invertebrate pests MERIAL LTD 2012-09-19 — — CN disclosed
WO-2012065944-A1 N-ARYL PYRAZOLE(THIO)CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2012-05-24 — — WO disclosed
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