SCHEMBL8622701

SCHEMBL8622701

O=C(NC(=O)c1ccccc1Cl)Nc1ccc(Sc2ccc(C(F)(F)F)cc2Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.55
RORC P51449 1/20 0.51
PLCG2 P16885 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
PCTP Q9UKL6 1/20 0.46
AVPR2 P30518 1/20 0.45
GPR27 Q9NS67 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
HTT P42858 2/20 0.45
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
GAA P10253 3/20 0.45
GCGR P47871 1/20 0.44
POLB P06746 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PKM P14618 1/20 0.44

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 0.92 TDP1 (0.55) TDP1RORCPLCG2RXFP1PCTP
SCHEMBL8624438 0.89 TDP1 (0.62) TDP1RORCPLCG2RXFP1PCTP
SCHEMBL8662539 0.88 GCGR (0.65) TDP1PLCG2LMNAMAPTHTT
SCHEMBL8662540 0.87 TDP1 (0.59) TDP1RORCPLCG2RXFP1LMNA
SCHEMBL8620837 0.86 PYGL (0.46) TDP1RORCPLCG2RXFP1SMN1; SMN2
SCHEMBL8621586 0.84 IL2 (0.54) MAPTALDH1A1MEN1KMT2AGAA
Chlotrifmeuron SCHEMBL10868747 0.84 TDP1 (0.70) TDP1RORCPLCG2RXFP1PCTP
SCHEMBL11138807 0.84 GCGR (0.62) TDP1PLCG2PCTPLMNAMAPT
SCHEMBL9743052 0.82 TRPV1 (0.47) TDP1RORCPLCG2RXFP1SMN1; SMN2
SCHEMBL11766283 0.81 MAPT (0.49) MAPTALDH1A1KMT2AKDR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5854288-A Use of benzoylureas for controlling house dust mites HOECHST SCHERING AGREVO GMBH (DE) 1998-12-29 US disclosed
EP-0729301-A1 USE OF BENZOYLUREAS FOR CONTROLLING HOUSE DUST MITES Hoechst Schering AgrEvo GmbH (DE) 1996-09-04 EP disclosed
WO-1995013703-A1 USE OF BENZOYLUREAS FOR CONTROLLING HOUSE DUST MITES HOECHST SCHERING AGREVO GMBH (DE) 1995-05-26 WO disclosed