SCHEMBL1848196

SCHEMBL1848196

COC(=O)c1cc2ccc(OC)cc2c2c1C=CC(c1ccc(OC)cc1)(c1ccc(OC)cc1)O2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.41
NR4A2 P43354 1/20 0.39
KDM4E B2RXH2 7/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
ALDH1A1 P00352 6/20 0.39
HPGD P15428 6/20 0.39
HSD17B10 Q99714 5/20 0.39
HTT P42858 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MTNR1A P48039 2/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL7785467 0.91 KDM4E (0.39) PLA2G2ANR4A2KDM4ECYP2C9CYP2C19
SCHEMBL1845591 0.90 KDM4E (0.43) KDM4ECYP2C9CYP2C19ALDH1A1HPGD
SCHEMBL1847688 0.90 GABRG2 (0.37) PLA2G2AKDM4ECYP2C9CYP2C19CYP1A2
SCHEMBL6131930 0.89 L3MBTL1 (0.39) PLA2G2AKDM4ECYP2C9CYP2C19CYP1A2
SCHEMBL5550993 0.89 MAPT (0.38) KDM4ECYP2C9CYP2C19ALDH1A1HPGD
SCHEMBL1845080 0.87 KEAP1 (0.38) KDM4ECYP2C9CYP2C19ALDH1A1HPGD
SCHEMBL6131929 0.86 KMT2A (0.39) PLA2G2AKDM4ECYP2C19ALDH1A1HPGD
SCHEMBL1845404 0.85 KMT2A (0.43) KDM4EALDH1A1HTTMEN1KMT2A
SCHEMBL4798246 0.85 PLA2G2A (0.41) PLA2G2ANR4A2KDM4ECYP2C9CYP2C19
SCHEMBL5551024 0.85 KMT2A (0.42) KDM4EALDH1A1HSD17B10HTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0971914-B1 NEUTRAL COLOURING PHOTOCHROMIC 2H-NAPHTHO 1,2-b PYRANS AND HETEROCYCLIC PYRANS VIVIMED LABS EUROP LTD (GB) 2011-05-18 EP disclosed
EP-0975619-B1 INTENSE COLOURING PHOTOCHROMIC 2H-NAPHTHO[1,2-b] PYRANS AND HETEROCYCLIC PYRANS JAMES ROBINSON LTD (GB) 2007-01-03 EP disclosed
EP-1140892-A1 PHOTOCHROMIC SUBSTIITUTED 2H-NAPHTHO[1,2-B]PYRANS JAMES ROBINSON LIMITED (GB) 2001-10-10 EP disclosed
US-6248264-B1 WINDOWS OR EYEGLASS/SUNGLASS LENSES HAVING GOOD DARKENING AND LIGHTENING PERFORMANCE WITH HIGH OPTICAL DENSITY JAMES ROBINSON LIMITED (GB) 2001-06-19 US disclosed
WO-2000035902-A1 PHOTOCHROMIC SUBSTITUTED 2H-NAPHTHO[1,2-b]PYRANS JAMES ROBINSON LIMITED (GB) 2000-06-22 WO disclosed
EP-0975619-A1 INTENSE COLOURING PHOTOCHROMIC 2$i(H)-NAPHTHO 1,2-$i(b)]PYRANS AND HETEROCYCLIC PYRANS JAMES ROBINSON LIMITED (GB) 2000-02-02 EP disclosed
EP-0971914-A2 NEUTRAL COLOURING PHOTOCHROMIC 2$i(H)-NAPHTHO 1,2-$i(b)]PYRANS AND HETEROCYCLIC PYRANS JAMES ROBINSON LIMITED (GB) 2000-01-19 EP disclosed
WO-1998042693-A2 NEUTRAL COLOURING PHOTOCHROMIC 2H-NAPHTHO[1,2-b]PYRANS AND HETEROCYCLIC PYRANS JAMES ROBINSON LIMITED (GB) 1998-10-01 WO disclosed
WO-1998042695-A1 INTENSE COLOURING PHOTOCHROMIC 2H-NAPHTHO[1,2-b]PYRANS AND HETEROCYCLIC PYRANS JAMES ROBINSON LIMITED (GB) 1998-10-01 WO disclosed