SCHEMBL8380679

SCHEMBL8380679

CC(C)(C)C(=O)Oc1ccc(Cn2ccccc2=O)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KLKB1 P03952 14/20 0.40
KLK1 P06870 2/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
ELANE P08246 1/20 0.38

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
SCHEMBL7635767 0.79 HTT (0.46) NPSR1KLKB1MAPT
SCHEMBL7630112 0.76 PPARG (0.41) ALDH1A1MAPTELANE
SCHEMBL8840670 0.76 SMN1; SMN2 (0.41) POLBNPSR1KLKB1KLK1ALDH1A1
SCHEMBL8378861 0.74 POLB (0.54) POLBNPSR1KLKB1
SCHEMBL7628046 0.74 ELANE (0.45) ALDH1A1ELANE
SCHEMBL8784367 0.73 KLKB1 (0.52) KLKB1KLK1
SCHEMBL27469136 0.72 ELANE (0.43) ALDH1A1ELANE
SCHEMBL25344894 0.72 POLB (0.54) POLBNPSR1KLKB1MAPT
SCHEMBL29976282 0.72 LMNA (0.51) ALDH1A1KDM4EMAPT
SCHEMBL9752787 0.71 POLB (0.63) POLBNPSR1KLKB1KLK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1079794-C Ether compound, use thereof, and intermediate for producing the compound SUMITOMO CHEM IND (JP) 2002-02-27 CN disclosed
US-5972949-A COMPOUNDS SUCH AS 4-(1-PYRAZOLYL)METHYLPHENYL 2-(2-PYRIMIDYLOXY) ETHYL ETHER; INSECTICIDAL AND/OR ACARICIDAL AGENTS SUMITO CHEMICAL CO., LTD. (JP) 1999-10-26 US disclosed
US-5883262-A INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-03-16 US disclosed
US-5684022-A ANTIFERTILITY AGENT PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-11-04 US disclosed
CN-1149289-A Ether compounds, their use and intermediates for their preparation SUMITOMO CHEMICAL CO (JP) 1997-05-07 CN disclosed
EP-0757048-A1 ETHER COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1997-02-05 EP disclosed
EP-0754683-A1 ETHER COMPOUND, USE THEREOF, AND INTERMEDIATE FOR PRODUCING THE COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1997-01-22 EP disclosed