SCHEMBL6131935

SCHEMBL6131935

COC(=O)c1cc(O)c2cc(OC)c(OC)cc2c1-c1ccc(OC)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.49
MAPK1 P28482 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 4/20 0.45
KMT2A Q03164 2/20 0.44
SLC10A2 Q12908 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KDM4E B2RXH2 2/20 0.43
PDE3B Q13370 2/20 0.43
PDE3A Q14432 2/20 0.43
PDE1A P54750 1/20 0.43
PDE1B Q01064 1/20 0.43
PDE1C Q14123 1/20 0.43
ERN1 O75460 1/20 0.43

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
SCHEMBL1711290 0.89 DHODH (0.56) DHODHMAPK1MAPTKMT2AALDH1A1
SCHEMBL6818270 0.87 ALDH1A1 (0.50) DHODHMAPK1MAPTKMT2AALDH1A1
SCHEMBL9860541 0.87 TUBB4A (0.54) L3MBTL1MAPTKMT2ASLC10A2ALDH1A1
SCHEMBL163789 0.86 SLC6A3 (0.45) DHODHL3MBTL1MAPTALDH1A1HSD17B10
SCHEMBL1334120 0.86 DHODH (0.46) DHODHMAPK1MAPTKMT2AALDH1A1
SCHEMBL30128969 0.86 DHODH (0.46) DHODHMAPK1MAPTKMT2AALDH1A1
SCHEMBL8531421 0.84 MAPT (0.45) DHODHL3MBTL1MAPTALDH1A1HPGD
SCHEMBL22149138 0.83 CFTR (0.45) L3MBTL1MAPTKMT2AALDH1A1HPGD
SCHEMBL6131895 0.83 DHODH (0.46) DHODHMAPK1L3MBTL1MAPTKMT2A
SCHEMBL1958066 0.80 CNR2 (0.41) ALDH1A1HPGDKDM4EPDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1214310-B1 NOVEL PHOTOCHROMIC NAPHTHOPYRANS TRANSITIONS OPTICAL INC (US) 2005-04-27 EP disclosed
EP-1214311-B1 NOVEL INDENO-FUSED PHOTOCHROMIC NAPHTHOPYRANS TRANSITIONS OPTICAL INC (US) 2004-09-15 EP disclosed
EP-1214311-A1 NOVEL INDENO-FUSED PHOTOCHROMIC NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 2002-06-19 EP disclosed
US-6348604-B1 COMPOUNDS IN WHICH SELECTION AND PLACEMENT OF SUBSTITUENTS CONTROL WAVELENGTH AND/OR INTENSITY OF VISIBLE ABSORBANCE BANDS PPG INDUSTRIES OHIO, INC. 2002-02-19 US disclosed
US-6296785-B1 OPHTHALMIC AND CONTACT LENSES; WINDOWS, SAFETY GLASS FOR CARS PPG INDUSTRIES OHIO, INC. 2001-10-02 US disclosed
WO-2001019813-A1 NOVEL INDENO-FUSED PHOTOCHROMIC NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 2001-03-22 WO disclosed