SCHEMBL10387602

SCHEMBL10387602

CC(Oc1ccc(-c2ccc(C(F)(F)F)cn2)cc1O)C(=O)Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.40
P2RX7 Q99572 1/20 0.40
TDO2 P48775 2/20 0.39
IDO1 P14902 1/20 0.39
SYK P43405 1/20 0.37
MCHR1 Q99705 1/20 0.37
ABCB11 O95342 1/20 0.37
PPARD Q03181 3/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
POLB P06746 1/20 0.35
DGAT1 O75907 2/20 0.35
PPARA Q07869 1/20 0.35
ALOX5AP P20292 2/20 0.35
FEN1 P39748 2/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL10838777 0.90 ABCB11 (0.47) KIF11P2RX7TDO2IDO1SYK
SCHEMBL9820726 0.90 ABCB11 (0.47) KIF11P2RX7TDO2IDO1SYK
SCHEMBL10637876 0.86 POLB (0.47) KIF11P2RX7TDO2IDO1PPARD
SCHEMBL10513666 0.84 GRIA2 (0.40) P2RX7IDO1KDM4E
SCHEMBL11368966 0.83 KIF11 (0.43) KIF11P2RX7TDO2IDO1SYK
SCHEMBL9371133 0.83 PPARD (0.39) KIF11P2RX7PPARDPTGDR2POLB
SCHEMBL9804260 0.83 KMT2A (0.37) ABCB11PPARDPTGDR2MEN1KMT2A
SCHEMBL10388787 0.83 MAPK1 (0.44) MEN1KMT2APOLBKDM4EL3MBTL1
SCHEMBL10646401 0.82 POLB (0.37) KIF11P2RX7TDO2IDO1PPARD
SCHEMBL11388460 0.81 PPARD (0.42) KIF11P2RX7TDO2IDO1PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4925947-A AGRICULTURAL USE, SENSITIVE TO CROPS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-05-15 US disclosed
EP-0215733-B1 PYRIDYLOXYPHENOXYPROPIONIC ACID DERIVATIVES SANDOZ AG (CH) 1989-06-21 EP disclosed
EP-0001473-B1 HERBICIDAL HALOGENOMETHYL--PYRIDYLOXY-PHENOXY-ALKANECARBOXYLIC ACIDS AND DERIVATIVES, AND PROCESSES OF CONTROLLING UNWANTED PLANTS THEREWITH IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-07-27 EP disclosed
US-4661148-A Pent-2-en-4-on-2-yl 2-(4-(5-trifluoromethyl-2-pyridinyloxy)phenoxy)propanoate useful for increasing recoverable sugar in sugar cane SANDOZ LTD. (CH) 1987-04-28 US disclosed
US-4657577-A LOW DOSAGE, GRASSES, WEEDS BAYER AKTIENGESELLSCHAFT (DE) 1987-04-14 US disclosed
EP-0215733-A1 Pyridyloxyphenoxypropionic acid derivatives SANDOZ AG (CH) 1987-03-25 EP disclosed
EP-0112531-B1 OPTICALLY ACTIVE DERIVATIVES OF PHENOXYPROPIONIC ACID BAYER AG (DE) 1987-03-04 EP disclosed
US-4629497-A Certain 1-(N-methylsulfonamido)-prop-2-yl 2-/4-(pyrid-2-yloxy)phenoxy/-propionate derivatives and their use for increasing recoverable sugar contained in sugar cane SANDOZ LTD. (CH) 1986-12-16 US disclosed
US-4585870-A POSTEMERGENCE HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1986-04-29 US disclosed
US-4555575-A CHLORINATION OF A DISUBSTITUTED METHYL PYRIDINE HYDROCHLORIDE SALT IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1985-11-26 US disclosed
US-4518416-A Certain trimethyl silyl-lower-alkyl esters of pyridyloxy-phenoxy-lower alkanoic acids, compositions containing same and herbicidal method of use BAYER AKTIENGESELLSCHAFT (DE) 1985-05-21 US disclosed
US-4508907-A 2,3-Dichloro-5-trichloromethylpyridine IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1985-04-02 US disclosed
US-4324627-A CHLORINATION OF 3-METHYLPYRIDINE UNDER INFLUENCE OF ULTRA VIOLET LIGHT IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1982-04-13 US disclosed
US-4317913-A Herbicidal pyridine compounds IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1982-03-02 US disclosed
EP-0028870-A1 Phenoxypyridine compound IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-05-20 EP disclosed
EP-0001473-A2 Herbicidal halogenomethyl--pyridyloxy-phenoxy-alkanecarboxylic acids and derivatives, and processes of controlling unwanted plants therewith IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1979-04-18 EP disclosed