SCHEMBL5314369

SCHEMBL5314369

O=C=NC(=O)c1ccc(F)cc1F

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 3/20 0.57
▸ CES1 P23141 3/20 0.57
▸ GPR6 P46095 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ RAB9A P51151 2/20 0.39
▸ SNCA P37840 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HTT P42858 1/20 0.36

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
SCHEMBL10585954 0.85 CES2 (0.57) CES2CES1MAPTALDH1A1
SCHEMBL5824353 0.84 CES2 (0.55) CES2CES1GPR6L3MBTL1RAB9A
SCHEMBL10747308 0.82 CES2 (0.40) CES2CES1RAB9ANPC1MAPT
SCHEMBL15539727 0.82 MAP2K1 (0.39) CES2CES1
SCHEMBL2916902 0.82 HPGD (0.46) CES2CES1RAB9ANPC1POLB
SCHEMBL16590409 0.82 CPS1 (0.39) CES2CES1RAB9ANPC1MAPT
SCHEMBL8348114 0.82 TRPA1 (0.42) CES2CES1RAB9ANPC1ALDH1A1
SCHEMBL15541210 0.80 GAA (0.48) CES2L3MBTL1KDM4EALDH1A1HTT
SCHEMBL10803361 0.79 CES2 (0.40) CES2CES1TDP1ALDH1A1
SCHEMBL11010263 0.79 CES2 (0.40) CES2CES1RAB9ANPC1MAPT

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
WO-2007066496-A1 BENZOYLUREA COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-14 — — WO disclosed
WO-1999033790-A1 INSECTICIDAL FLUORO-SUBSTITUTED BENZOYLUREAS NIHON BAYER AGROCHEM K.K. (DE) 1999-07-08 — — WO disclosed
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