SCHEMBL8657600

SCHEMBL8657600

O=C(NC(=O)c1c(F)cccc1F)Nc1cc(Cl)c(Oc2ccc([N+](=O)[O-])cc2Cl)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 11/20 0.52
KMT2A Q03164 11/20 0.52
GAA P10253 2/20 0.49
PKM P14618 1/20 0.49
MAPT P10636 9/20 0.48
LMNA P02545 6/20 0.48
ALDH1A1 P00352 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
HTT P42858 3/20 0.48
MAPK1 P28482 2/20 0.48
RAB9A P51151 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
XBP1 P17861 1/20 0.48
CCR6 P51684 1/20 0.48
NPC1 O15118 1/20 0.46
USP2 O75604 1/20 0.43
ALOX15 P16050 1/20 0.43
HSP90AA1 P07900 1/20 0.43
THRA P10827 1/20 0.43
RORC P51449 1/20 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
SCHEMBL8657138 0.89 PTGDR2 (0.43) MEN1KMT2AGAAPKMMAPT
SCHEMBL9135345 0.88 MAPT (0.47) MEN1KMT2AGAAPKMMAPT
SCHEMBL8657566 0.86 GCGR (0.49) MEN1KMT2AGAAMAPTALDH1A1
SCHEMBL11032023 0.85 KMT2A (0.45) MEN1KMT2AGAAMAPTLMNA
SCHEMBL8663051 0.84 MEN1 (0.47) MEN1KMT2AGAAPKMMAPT
SCHEMBL10749067 0.83 PYGL (0.52) MEN1KMT2AGAAPKMMAPT
SCHEMBL8660336 0.83 MAPT (0.47) MEN1KMT2AGAAPKMMAPT
SCHEMBL8659884 0.82 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL11244545 0.82 MAPT (0.49) MEN1KMT2AGAAMAPTLMNA
SCHEMBL9132218 0.81 KMT2A (0.44) MEN1KMT2AMAPTLMNAALDH1A1

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 6 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
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