SCHEMBL2861240

SCHEMBL2861240

CC(Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)O[PH2]=O.[Ni]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 2/20 0.52
ALDH1A1 P00352 7/20 0.43
TSHR P16473 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPK1 P28482 3/20 0.43
MAPT P10636 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
BLM P54132 2/20 0.43
ATM Q13315 2/20 0.43
HIF1A Q16665 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
USP2 O75604 1/20 0.43
CYP2D6 P10635 1/20 0.43
GAA P10253 3/20 0.42
LMNA P02545 2/20 0.42
GMNN O75496 1/20 0.41
GABBR2 O75899 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL10426639 0.77 HMGCR (0.65) HMGCRALDH1A1TSHRMEN1KMT2A
SCHEMBL2279290 0.77 HMGCR (0.54) HMGCRALDH1A1TSHRMEN1KMT2A
SCHEMBL10426640 0.76 HMGCR (0.63) HMGCRALDH1A1TSHRMEN1KMT2A
SCHEMBL2279291 0.76 HMGCR (0.52) HMGCRALDH1A1TSHRMEN1KMT2A
SCHEMBL39082 0.75 HMGCR (0.57) HMGCRALDH1A1TSHRMEN1KMT2A
SCHEMBL10769689 0.74 HMGCR (0.54) HMGCRALDH1A1TSHRMEN1KMT2A
SCHEMBL1278385 0.74 HMGCR (0.54) HMGCRALDH1A1TSHRMEN1KMT2A
SCHEMBL2671331 0.74 HMGCR (0.53) HMGCRALDH1A1TSHRMEN1KMT2A
SCHEMBL7184451 0.74 HMGCR (0.50) HMGCRALDH1A1TSHRMEN1KMT2A
SCHEMBL28846430 0.74 HMGCR (0.60) HMGCRALDH1A1TSHRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100239792-A1 THERMAL PRINTING LAYER AND OPTICAL RECORDING MEDIUM USING THE THERMAL PRINTING LAYER MITSUBISHI KAGAKU MEDIA CORPORATION, LTD. (JP) 2010-09-23 US disclosed
EP-2011662-B1 OPTICAL RECORDING MEDIUM WITH A HEAT-SENSITIVE PRINTING LAYER MITSUBISHI KAGAKU MEDIA CO LTD (JP) 2010-07-07 EP disclosed
US-20090209421-A1 THERMAL PRINTING LAYER AND OPTICAL RECORDING MEDIUM MITSUBISHI KAGAKU MEDIA CO., LTD. (JP) 2009-08-20 US disclosed
EP-2011662-A1 HEAT-SENSITIVE PRINTING LAYER AND OPTICAL RECORDING MEDIUM Mitsubishi Kagaku Media Co., Ltd. (JP) 2009-01-07 EP disclosed
EP-2011663-A1 HEAT-SENSITIVE PRINTING LAYER AND OPTICAL RECORDING MEDIUM USING THE HEAT-SENSITIVE PRINTING LAYER Mitsubishi Kagaku Media Co., Ltd. (JP) 2009-01-07 EP disclosed
EP-0908501-B1 Reversible thermochromic composition PILOT INK CO LTD (JP) 2003-07-09 EP disclosed
EP-0678377-B1 Thermochromic laminate PILOT INK CO LTD (JP) 2000-09-20 EP disclosed
US-6048387-A SPECIFIED DIAZARHODAMINE LACTONE DERIVATIVE AS AN ELECTRON-DONATING COLOR-DEVELOPING ORGANIC COMPOUND THE PILOT INK CO., LTD. (JP) 2000-04-11 US disclosed
EP-0908501-A1 Reversible thermochromic composition THE PILOT INK CO., LTD. (JP) 1999-04-14 EP disclosed
US-5688592-A Thermochromic laminate comprising light intercepting pigment and light stabilizer THE PILOT INK CO., LTD. (JP) 1997-11-18 US disclosed
EP-0678377-A1 Thermochromic laminate THE PILOT INK CO., LTD. (JP) 1995-10-25 EP disclosed