SCHEMBL8662540

SCHEMBL8662540

O=C(NC(=O)c1ccccc1Cl)Nc1ccc(Oc2ccc(Sc3ccc(C(F)(F)F)cc3Cl)c(Cl)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.59
GCGR P47871 1/20 0.52
TLR8 Q9NR97 5/20 0.48
TLR7 Q9NYK1 3/20 0.48
RORC P51449 1/20 0.47
RAF1 P04049 2/20 0.44
KDR P35968 5/20 0.43
BRAF P15056 3/20 0.43
PLCG2 P16885 1/20 0.43
MAPK14 Q16539 3/20 0.43
TNNI3K Q59H18 3/20 0.43
PLK4 O00444 2/20 0.43
AURKA O14965 2/20 0.43
MAPK13 O15264 2/20 0.43
MAP4K4 O95819 2/20 0.43
ABL1 P00519 2/20 0.43
LCK P06239 2/20 0.43
FYN P06241 2/20 0.43
LYN P07948 2/20 0.43
RET P07949 2/20 0.43

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
SCHEMBL8620555 0.89 TDP1 (0.55) TDP1GCGRRORCKDRPLCG2
SCHEMBL8622701 0.87 TDP1 (0.55) TDP1GCGRRORCKDRPLCG2
SCHEMBL8657705 0.86 TLR8 (0.60) TLR8TLR7RAF1KDRBRAF
SCHEMBL8661111 0.86 TDP1 (0.58) TDP1GCGRTLR8TLR7RORC
SCHEMBL8662539 0.86 GCGR (0.65) TDP1GCGRPLCG2HTTPOLB
SCHEMBL8659897 0.85 GCGR (0.72) TDP1GCGRTLR8TLR7RORC
SCHEMBL8656261 0.85 TLR8 (0.49) TLR8TLR7RAF1KDRBRAF
SCHEMBL9325879 0.83 GCGR (0.69) TDP1GCGRTLR8TLR7RORC
Chlotrifmeuron SCHEMBL10868747 0.80 TDP1 (0.70) TDP1GCGRRORCPLCG2ALDH1A1
SCHEMBL9743052 0.80 TRPV1 (0.47) TDP1RORCKDRPLCG2ALDH1A1

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