SCHEMBL4468889

SCHEMBL4468889

CC(C)c1ccc(C(=O)C2(O)CCCCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.46
ALDH1A1 P00352 5/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 1/20 0.46
CYP2C9 P11712 1/20 0.42
USP5 P45974 1/20 0.41
HTT P42858 1/20 0.39
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
CTSK P43235 1/20 0.38
TP53 P04637 1/20 0.38
EPHX1 P07099 1/20 0.38
NFKB1 P19838 1/20 0.38
EPHX2 P34913 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
DEGS1 O15121 1/20 0.37

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
SCHEMBL4418777 0.84 RXRA (0.41) LMNA
SCHEMBL13431254 0.84 NPSR1 (0.41) SMN1; SMN2ALDH1A1MEN1KMT2ARAB9A
SCHEMBL10067692 0.81 PKM (0.35) ALDH1A1KMT2ALMNACYP2C9MAPT
SCHEMBL28505006 0.80 RAB9A (0.41) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL7636775 0.80 HSD11B1 (0.46) ALDH1A1LMNA
SCHEMBL256587 0.80 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL10943813 0.80 CES2 (0.39)
SCHEMBL6696391 0.80 SRD5A2 (0.39) SMN1; SMN2ALDH1A1LMNAHTTRAB9A
SCHEMBL11303491 0.78 HDAC4 (0.47) ALDH1A1KMT2ALMNAMAPT
SCHEMBL10943780 0.77 CES2 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1760102-B1 CATIONICALLY PHOTOPOLYMERIZABLE COMPOSITION AND OPTOELECTRONIC COMPONENT USING SAME THREE BOND CO LTD (JP) 2013-04-24 EP disclosed
EP-2065444-A1 PHOTOPOLYMERIZABLE COMPOSITION THREE BOND CO., LTD. (JP) 2009-06-03 EP disclosed
EP-1760102-A1 CATIONICALLY PHOTOPOLYMERIZABLE COMPOSITION AND OPTOELECTRONIC COMPONENT USING SAME THREE BOND CO., LTD. (JP) 2007-03-07 EP disclosed
US-7084187-B2 Curable liquid resin composition DSM IP ASSETS B.V. (NL) 2006-08-01 US disclosed
EP-1165682-B1 RESIN COMPOSITION AND CURED PRODUCT DSM IP ASSETS BV (NL) 2006-07-05 EP disclosed
WO-2006065124-A1 RADIATION CURABLE RESIN COMPOSITION AND CURED FILM JSR CORPORATION (JP) 2006-06-22 WO disclosed
US-20050070623-A1 Curable liquid resin composition JSR CORPORATION (JP) 2005-03-31 US disclosed
US-6727334-B2 FOR FORMING COATINGS WITH HIGH HARDNESS, SCRATCH RESISTANCE, LOW CURLING PROPERTIES, ADHESION, AND TRANSPARENCY, AND FINE APPEARANCE ON THE SURFACE OF VARIOUS SUBSTRATES FOR SUCH AS PLASTICS DSM N.V. (NL) 2004-04-27 US disclosed
WO-2003027191-A2 CURABLE LIQUID RESIN COMPOSITION DSM IP ASSETS B.V. (NL) 2003-04-03 WO disclosed
US-20020058737-A1 Resin composition and cured product JSR CORPORATION (JP) 2002-05-16 US disclosed
EP-1165682-A1 RESIN COMPOSITION AND CURED PRODUCT DSM N.V. (NL) 2002-01-02 EP disclosed
WO-2000047666-A1 RESIN COMPOSITION AND CURED PRODUCT DSM N.V. (NL) 2000-08-17 WO disclosed