SCHEMBL8618906

SCHEMBL8618906

O=C(NC(=O)c1ccccc1Cl)Nc1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1F

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 1/20 0.56
▸ TDP1 Q9NUW8 2/20 0.49
▸ PYGL P06737 3/20 0.48
▸ BRAF P15056 6/20 0.47
▸ KDR P35968 2/20 0.47
▸ PNLIP P16233 2/20 0.47
▸ TRPV1 Q8NER1 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ TTR P02766 1/20 0.46
▸ PPOX P50336 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ FFAR1 O14842 2/20 0.44

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
SCHEMBL9326642 0.98 GCGR (0.54) GCGRTDP1PYGLBRAFKDR
SCHEMBL9326325 0.89 MEN1 (0.48) TDP1BRAFKDRPNLIPMEN1
Flufenoxuron SCHEMBL29413952 0.87 MEN1 (0.52) BRAFKDRMEN1KMT2AFFAR1
Flufenoxuron SCHEMBL8407576 0.87 MEN1 (0.52) BRAFKDRMEN1KMT2AFFAR1
Flufenoxuron SCHEMBL27798 0.87 MEN1 (0.52) BRAFKDRMEN1KMT2AFFAR1
SCHEMBL8659897 0.86 GCGR (0.72) GCGRTDP1PNLIPFFAR1
SCHEMBL9325616 0.86 MEN1 (0.51) TDP1BRAFKDRMEN1TTR
SCHEMBL10338942 0.85 BRAF (0.46) TDP1BRAFKDRMEN1TTR
Flufenoxuron SCHEMBL28899111 0.85 MEN1 (0.50) BRAFKDRMEN1KMT2A
SCHEMBL9325879 0.84 GCGR (0.69) GCGRTDP1PNLIPMEN1TTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5854288-A Use of benzoylureas for controlling house dust mites HOECHST SCHERING AGREVO GMBH (DE) 1998-12-29 — — US disclosed
EP-0729301-A1 USE OF BENZOYLUREAS FOR CONTROLLING HOUSE DUST MITES Hoechst Schering AgrEvo GmbH (DE) 1996-09-04 — — EP disclosed
WO-1995013703-A1 USE OF BENZOYLUREAS FOR CONTROLLING HOUSE DUST MITES HOECHST SCHERING AGREVO GMBH (DE) 1995-05-26 — — WO disclosed
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