SCHEMBL6014072

SCHEMBL6014072

[CH2]C(O)(Cl)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
CYP1A2 P05177 2/20 0.48
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 4/20 0.39
KCNN4 O15554 4/20 0.39
ALOX15 P16050 1/20 0.37
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
CYP3A4 P08684 2/20 0.36
PTPN1 P18031 1/20 0.36
MAPK1 P28482 2/20 0.35
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
CYP2D6 P10635 1/20 0.34
HRH1 P35367 1/20 0.34
SCN1A P35498 1/20 0.34

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
SCHEMBL1384161 0.77 CYP1A2 (0.44) TSHRCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL4747863 0.77 TSHR (0.58) TSHRCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL30172471 0.77 TSHR (0.58) TSHRCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL1829408 0.77 TSHR (0.58) TSHRCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL10954237 0.77 TSHR (0.58) TSHRCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL6361861 0.77 TSHR (0.58) TSHRCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL2201549 0.77 CYP1A2 (0.44) TSHRCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL456764 0.77 TSHR (0.58) TSHRCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL8519505 0.74 TSHR (0.55) TSHRCYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL4448673 0.73 TSHR (0.61) TSHRCYP1A2CYP2C9CYP2C19ALDH1A1

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
EP-1193564-B1 Toner, developer and container for the developer, and method of and apparatus for forming an image RICOH KK (JP) 2006-04-05 EP disclosed
US-6733939-B2 FOR USE IN DEVELOPER DURING ELECTROPHOTOGRAPHY, ELECTROSTATIC RECORDING, ELECTROSTATIC PRINTING; CHARGE CONTROL AGENTS INCREASE DISPERSIBILITY IN RESIN; NO VARIATION IN THE TONER CHARGEABILITY AFTER CONTINUOUS PRINTING RICOH COMPANY, LTD. (JP) 2004-05-11 US disclosed
US-20020064723-A1 Toner, developer and container for the developer, and method of and apparatus for forming an image RICOH COMPANY, LTD. (JP) 2002-05-30 US disclosed
EP-1193564-A2 Toner, developer and container for the developer, and method of and apparatus for forming an image Ricoh Company, Ltd. (JP) 2002-04-03 EP disclosed
CN-1216986-A Isoxazole derivatives SANKYO CO (JP) 1999-05-19 CN disclosed
CN-86107767-A NOVEL ORGANIC SELENIUM COMPOUNDS 1987-08-05 CN disclosed