SCHEMBL9159900

SCHEMBL9159900

O=C(NCCOc1ccc(Oc2cccc(Cl)c2)cc1Cl)OCCCCl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
PPARD Q03181 3/20 0.45
PPARA Q07869 2/20 0.45
EPHX2 P34913 1/20 0.43
MAPK1 P28482 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TP53 P04637 1/20 0.42
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
MAPT P10636 3/20 0.41
TSHR P16473 3/20 0.41
HTT P42858 2/20 0.41
LMNA P02545 1/20 0.41
FAAH O00519 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PPARG P37231 3/20 0.40

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
SCHEMBL9163309 0.95 PPARD (0.43) HRH4HRH3PPARDPPARAEPHX2
SCHEMBL9163409 0.89 PPARA (0.43) HRH4HRH3PPARDPPARAEPHX2
SCHEMBL9161951 0.89 HRH4 (0.42) HRH4HRH3PPARDPPARAEPHX2
SCHEMBL9157654 0.89 HRH4 (0.42) HRH4HRH3PPARDPPARAEPHX2
SCHEMBL9165279 0.89 PPARA (0.44) HRH4HRH3PPARDPPARAEPHX2
SCHEMBL9160265 0.88 HRH4 (0.43) HRH4HRH3PPARDPPARAEPHX2
SCHEMBL9163570 0.88 L3MBTL1 (0.45) PPARDPPARAEPHX2MAPK1L3MBTL1
SCHEMBL9160000 0.87 MAPT (0.46) PPARDPPARAMAPK1L3MBTL1TP53
SCHEMBL9162114 0.87 HTT (0.48) HRH4HRH3PPARDPPARAEPHX2
SCHEMBL9165467 0.87 LMNA (0.43) HRH4HRH3PPARDPPARAEPHX2

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
EP-0460472-B1 Carbamic acid derivatives, their production and use SUMITOMO CHEMICAL CO (JP) 1995-03-08 EP disclosed
US-5346920-A Insecticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-09-13 US disclosed
EP-0460472-A1 Carbamic acid derivatives, their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-12-11 EP disclosed