SCHEMBL8661111

SCHEMBL8661111

O=C(NC(=O)c1ccccc1Cl)Nc1ccc(Oc2ccc(S(=O)(=O)c3ccc(C(F)(F)F)cc3Cl)c(Cl)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.58
GCGR P47871 1/20 0.52
TLR8 Q9NR97 5/20 0.48
TLR7 Q9NYK1 3/20 0.48
RORC P51449 1/20 0.46
AVPR2 P30518 1/20 0.46
GPR27 Q9NS67 1/20 0.46
PCTP Q9UKL6 1/20 0.44
BRAF P15056 2/20 0.43
KDR P35968 2/20 0.43
PLCG2 P16885 1/20 0.43
ALDH1A1 P00352 2/20 0.42
RAB9A P51151 2/20 0.42
HTT P42858 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
MAPK14 Q16539 1/20 0.42
TNNI3K Q59H18 1/20 0.42
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42

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
SCHEMBL8658849 0.90 TLR8 (0.56) TDP1TLR8TLR7BRAFKDR
SCHEMBL8662619 0.86 TLR8 (0.59) TLR8TLR7BRAFKDRALDH1A1
SCHEMBL8661106 0.86 GCGR (0.64) TDP1GCGRAVPR2GPR27
SCHEMBL8662540 0.86 TDP1 (0.59) TDP1GCGRTLR8TLR7RORC
SCHEMBL8659897 0.84 GCGR (0.72) TDP1GCGRTLR8TLR7RORC
SCHEMBL9325879 0.83 GCGR (0.69) TDP1GCGRTLR8TLR7RORC
SCHEMBL8656699 0.81 GCGR (0.56) TDP1GCGRPCTPALDH1A1HTT
Chlotrifmeuron SCHEMBL10868747 0.79 TDP1 (0.70) TDP1GCGRRORCPCTPPLCG2
SCHEMBL8658915 0.78 TLR8 (0.57) TLR8TLR7ALDH1A1HTTLMNA
SCHEMBL15171164 0.77 RORC (0.66) TDP1TLR8TLR7RORCALDH1A1

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
US-5776981-A Use of acyl urea compounds for controlling endoparasites and ectoparasites of warm-blooded animals NOVARTIS CORPORATION (US) 1998-07-07 US disclosed
US-5776982-A Use of acyl urea compounds for controlling endoparasites and ectoparasites of warm-blooded animals NOVARTIS CORPORATION (US) 1998-07-07 US disclosed