SCHEMBL6169985

SCHEMBL6169985

COC(=O)c1c2c(c3ccccc3c1-c1ccccc1)OC(c1ccc(OC)cc1)(c1ccc(OC)cc1)C=C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.43
ATM Q13315 2/20 0.43
TP53 P04637 1/20 0.43
THRB P10828 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 2/20 0.38
PADI4 Q9UM07 3/20 0.37
ASAH1 Q13510 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
GPR84 Q9NQS5 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL6931279 0.92 SMN1; SMN2 (0.46) L3MBTL1ATMTP53THRBSMN1; SMN2
SCHEMBL6131950 0.91 L3MBTL1 (0.41) L3MBTL1ATMTP53THRBSMN1; SMN2
SCHEMBL5107968 0.91 MAPK8 (0.41) L3MBTL1ATMTP53THRBSMN1; SMN2
SCHEMBL1332525 0.91 ATM (0.40) L3MBTL1ATMTP53THRBSMN1; SMN2
SCHEMBL29565863 0.91 ATM (0.40) L3MBTL1ATMTP53THRBSMN1; SMN2
SCHEMBL5107921 0.90 L3MBTL1 (0.40) L3MBTL1ATMTP53THRBSMN1; SMN2
SCHEMBL10102253 0.89 SMN1; SMN2 (0.45) L3MBTL1ATMTP53SMN1; SMN2TDP1
SCHEMBL8920456 0.89 L3MBTL1 (0.39) L3MBTL1ATMTP53THRBSMN1; SMN2
SCHEMBL29565468 0.89 L3MBTL1 (0.39) L3MBTL1ATMTP53THRBSMN1; SMN2
SCHEMBL6131971 0.89 L3MBTL1 (0.41) L3MBTL1ATMTDP1LMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1360183-B1 NOVEL PHOTOCHROMIC INDENONAPHTHOPYRAN COMPOUNDS TRANSITIONS OPTICAL INC (US) 2005-08-17 EP disclosed
EP-1112263-B1 POLYMERIZABLE POLYALKOXYLATED NAPHTHOPYRANS TRANSITIONS OPTICAL INC (US) 2005-06-08 EP disclosed
EP-0835870-B1 Photochromic substituted naphthopyrans PPG IND OHIO INC (US) 2004-03-03 EP disclosed
US-6113814-A PHOTOCHROMIC; END-CAPPED WITH A POLYMERIZABLE GROUP. TRANSITIONS OPTICAL, INC. (US) 2000-09-05 US disclosed
EP-0835870-A1 Photochromic substituted naphthopyrans PPG INDUSTRIES, INC. (US) 1998-04-15 EP disclosed
US-5656206-A OPHTHALIMIC LENSES; RADIATION TRANSPARENT; PHOTOCHROMISM TRANSITIONS OPTICAL, INC. (US) 1997-08-12 US disclosed
US-5645767-A PLASTIC LENSES, WINDOWS, BATHOCHROMIC SHIFT FOR WAVELENGTHS IN VISIBLE SPECTRUM TRANSITIONS OPTICAL, INC. (US) 1997-07-08 US disclosed
WO-1996014596-A1 NOVEL PHOTOCHROMIC INDENO-FUSED NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 1996-05-17 WO disclosed