SCHEMBL6811511

SCHEMBL6811511

C=CC(O)(CCCCC)OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 1/20 0.43
CETP P11597 3/20 0.41
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
DRD2 P14416 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 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
SCHEMBL8709296 0.99 MBOAT4 (0.45) MBOAT4CETPGAAALDH1A1CYP3A4
SCHEMBL8707828 0.81 CETP (0.39) MBOAT4CETPGAAALDH1A1CYP3A4
SCHEMBL6811521 0.81 CETP (0.39) MBOAT4CETPGAAALDH1A1CYP3A4
SCHEMBL8709144 0.79 CETP (0.41) MBOAT4CETPMAPK1BCHEACHE
SCHEMBL16459448 0.76 CETP (0.47) MBOAT4CETPGAAALDH1A1CYP3A4
SCHEMBL10389226 0.74 CETP (0.44) MBOAT4CETPGAAALDH1A1CYP3A4
SCHEMBL1614607 0.74 CETP (0.47) MBOAT4CETPALDH1A1CYP3A4TSHR
SCHEMBL9116193 0.74 CETP (0.44) MBOAT4CETPGAAALDH1A1CYP3A4
SCHEMBL1614849 0.74 CETP (0.47) MBOAT4CETPALDH1A1CYP3A4TSHR
SCHEMBL9221499 0.73 CETP (0.43) MBOAT4CETPGAAALDH1A1CYP3A4

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-0764667-B1 FUNCTION-CONTAINING POROUS RESIN AND PROCESS FOR THE PRODUCTION THEREOF ARAKAWA CHEM IND (JP) 2004-12-08 EP disclosed
US-5731395-A POLYMER CONTAINING DIVINYLBENZENE AND STYRENE COMPOUND ARAKAWA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-24 US disclosed
EP-0764667-A1 FUNCTION-CONTAINING POROUS RESIN AND PROCESS FOR THE PRODUCTION THEREOF ARAKAWA CHEMICAL INDUSTRIES, LTD. (JP) 1997-03-26 EP disclosed