SCHEMBL719973

SCHEMBL719973

COc1ccc(C(=O)c2ccc(OCCO)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.72
MAPT P10636 5/20 0.62
LMNA P02545 3/20 0.58
RXFP1 Q9HBX9 2/20 0.58
MEN1 O00255 1/20 0.58
MAPK1 P28482 1/20 0.58
RAB9A P51151 1/20 0.58
KMT2A Q03164 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
HPGD P15428 1/20 0.58
L3MBTL1 Q9Y468 2/20 0.56
NR1I2 O75469 1/20 0.56
ALDH1A1 P00352 1/20 0.53
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
TUBB4A P04350 1/20 0.51
TUBB P07437 1/20 0.51
TUBA3C P0DPH7 1/20 0.51

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
SCHEMBL1816349 0.91 GAA (0.85) GAAMAPTLMNAMAPK1KMT2A
SCHEMBL77535 0.87 ALDH1A1 (0.60) GAAMAPTLMNANPSR1NR1I2
SCHEMBL14141694 0.86 MAPT (0.68) GAAMAPTLMNAMAPK1NR1I2
SCHEMBL6427017 0.86 MAPT (0.62) GAAMAPTLMNARXFP1MEN1
SCHEMBL1814631 0.86 MAPT (0.62) MAPTLMNARXFP1MEN1MAPK1
SCHEMBL10426837 0.86 MAPT (0.62) GAAMAPTLMNARXFP1MEN1
SCHEMBL25954201 0.85 GAA (0.77) GAAMAPTLMNAMAPK1KMT2A
SCHEMBL15067471 0.84 HPGD (0.61) GAAMAPTLMNARXFP1MEN1
SCHEMBL6350360 0.84 MAPT (0.61) GAAMAPTLMNARXFP1MEN1
SCHEMBL887049 0.84 GAA (1.00) GAAMAPTLMNAMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2494408-B9 PHOTOCHROMIC MATERIALS TRANSITIONS OPTICAL INC (US) 2015-09-02 EP disclosed
US-9028728-B2 Photochromic materials that include indeno-fused naphthopyrans TRANSITIONS OPTICAL, INC. (US) 2015-05-12 US disclosed
EP-2494408-B1 PHOTOCHROMIC MATERIALS TRANSITIONS OPTICAL INC (US) 2015-04-15 EP disclosed
US-8535577-B2 Photochromic materials that include 6-amino substituted indeno-fused naphthopyrans TRANSITIONS OPTICAL, INC. (US) 2013-09-17 US disclosed
US-8518305-B2 Photochromic materials TRANSITIONS OPTICAL, INC. (US) 2013-08-27 US disclosed
WO-2013086248-A1 PHOTOCHROMIC MATERIALS THAT INCLUDE INDENO-FUSED NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 2013-06-13 WO disclosed
US-8277699-B2 Photochromic materials that include 6-amino substituted indeno-fused naphthopyrans Transistions Optical, Inc. (US) 2012-10-02 US disclosed
EP-2494408-A1 PHOTOCHROMIC MATERIALS Transitions Optical, Inc. (US) 2012-09-05 EP disclosed
US-20120214992-A1 PHOTOCHROMIC MATERIALS THAT INCLUDE 6-AMINO SUBSTITUTED INDENO-FUSED NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 2012-08-23 US disclosed
US-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans TRANSITIONS OPTICAL INC. (US) 2012-06-14 US disclosed
US-20120053341-A1 PHOTOCHROMIC MATERIALS THAT INCLUDE 6-AMINO SUBSTITUTED INDENO-FUSED NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 2012-03-01 US disclosed
US-20110108781-A1 PHOTOCHROMIC MATERIALS TRANSITIONS OPTICAL, INC. (US) 2011-05-12 US disclosed
WO-2011053615-A1 PHOTOCHROMIC MATERIALS TRANSITIONS OPTICAL, INC. (US) 2011-05-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110108781-A1 PHOTOCHROMIC MATERIALS INCENP, SMCHD1, NEDD8 GAA 2712/4885MAPT 294/4885LMNA 256/4885
US-20120214992-A1 PHOTOCHROMIC MATERIALS THAT INCLUDE 6-AMINO SUBSTITUTED INDENO-FUSED NAPHTHOPYRANS NPEPPS, MITF, NR2E3 GAA 3370/4885MAPT 1148/4885LMNA 2621/4885
US-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans NQO1, INTS6, IPO4 GAA 2984/4885MAPT 2224/4885LMNA 650/4885
US-20120053341-A1 PHOTOCHROMIC MATERIALS THAT INCLUDE 6-AMINO SUBSTITUTED INDENO-FUSED NAPHTHOPYRANS MITF, NPEPPS, GNE GAA 2998/4885MAPT 1095/4885LMNA 1812/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.