SCHEMBL8662539

SCHEMBL8662539

O=C(NC(=O)c1ccccc1Cl)Nc1ccc(Oc2ccc(Sc3ccc(C(F)(F)F)cc3Cl)cc2)c(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.65
PNLIP P16233 9/20 0.53
TDP1 Q9NUW8 1/20 0.51
STK39 Q9UEW8 2/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
CYP3A4 P08684 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
CYP2C9 P11712 1/20 0.45
HPGD P15428 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.45
PARG Q86W56 2/20 0.42
PLCG2 P16885 1/20 0.42
PARP1 P09874 1/20 0.42
SCN8A Q9UQD0 1/20 0.42
SCN10A Q9Y5Y9 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
SCHEMBL9720327 0.91 GCGR (0.51) GCGRPNLIPSTK39KDM4E
SCHEMBL8659897 0.88 GCGR (0.72) GCGRPNLIPTDP1STK39
SCHEMBL8622701 0.88 TDP1 (0.55) GCGRTDP1KDM4ELMNAPOLB
SCHEMBL8657704 0.87 TLR8 (0.48) GCGRPNLIPSTK39KDM4EMAPT
SCHEMBL8656260 0.87 GCGR (0.47) GCGRPNLIPSTK39
SCHEMBL9325879 0.86 GCGR (0.69) GCGRPNLIPTDP1STK39
SCHEMBL8620555 0.86 TDP1 (0.55) GCGRTDP1LMNAPOLBGAA
SCHEMBL8662540 0.86 TDP1 (0.59) GCGRTDP1LMNAPOLBMAPT
SCHEMBL8661106 0.82 GCGR (0.64) GCGRPNLIPTDP1STK39
SCHEMBL8658021 0.81 GCGR (0.60) GCGRPNLIPTDP1STK39LMNA

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 10 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
US-5420163-A Insecticides or miticides CIBA-GEIGY (US) 1995-05-30 US disclosed
US-5135953-A Oral or injections; cattle, swine, poultry CIBA-GEIGY (US) 1992-08-04 US disclosed
EP-0211004-A1 USE OF ACYL UREA COMPOUNDS FOR CONTROLLING ENDOPARASITES AND ECTOPARASITES OF WARM-BLOODED ANIMALS RHONE-POULENC NEDERLAND B.V. (NL) 1987-02-25 EP disclosed
US-4602109-A Novel pesticidal phenoxyphenyl and phenoxypyridyl benzoyl ureas and process for preparation UNION CARBIDE CORPORATION (US) 1986-07-22 US disclosed
WO-1986003941-A1 USE OF ACYL UREA COMPOUNDS FOR CONTROLLING ENDOPARASITES AND ECTOPARASITES OF WARM-BLOODED ANIMALS UNION CARBIDE CORPORATION (US) 1986-07-17 WO disclosed
EP-0113247-B1 PESTICIDAL PHENOXYPHENYL AND PHENOXYPYRIDYL BENZOYL UREAS AND PROCESS FOR THEIR PREPARATION UNION CARBIDE CORPORATION (US) 1986-06-11 EP disclosed
US-4540578-A Pesticidal phenoxypyridyl benzoyl ureas UNION CARBIDE CORPORATION (US) 1985-09-10 US disclosed
EP-0113247-A1 Pesticidal phenoxyphenyl and phenoxypyridyl benzoyl ureas and process for their preparation UNION CARBIDE CORPORATION (US) 1984-07-11 EP disclosed