SCHEMBL1844408

SCHEMBL1844408

COc1ccc(C2(C3CC3)C=Cc3c(C)cc4ccccc4c3O2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 2/20 0.37
NFKB2 Q00653 2/20 0.37
RELA Q04206 2/20 0.37
GPR84 Q9NQS5 1/20 0.34
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
ATM Q13315 1/20 0.32
LMNA P02545 4/20 0.32
KMT2A Q03164 4/20 0.32
MEN1 O00255 3/20 0.32
ALOX5 P09917 1/20 0.32
RAB9A P51151 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL7825544 0.84 CHRM2 (0.36) NFKB1NFKB2RELAGPR84KDM4E
SCHEMBL6995620 0.82 GPR84 (0.38) NFKB1NFKB2RELAGPR84KDM4E
SCHEMBL9035449 0.81 NFKB1 (0.41) NFKB1NFKB2RELAMAPTKMT2A
SCHEMBL7528619 0.68 GPR84 (0.48) GPR84KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL7529928 0.68 GPR84 (0.46) GPR84KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL13104722 0.68 MAPT (0.39) ALDH1A1MAPTSMN1; SMN2HPGDNPC1
SCHEMBL9035829 0.67 HTR2C (0.34) NFKB1NFKB2RELA
SCHEMBL7782083 0.67 KDM4E (0.44) NFKB1NFKB2RELAGPR84KDM4E
SCHEMBL12659492 0.66 MAPT (0.35) KDM4EALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL17929234 0.65 ACP1 (0.34) GPR84KDM4EALDH1A1MAPTSMN1; SMN2

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 15 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-1117656-B1 GREY COLOURING PHOTOCHROMIC FUSED PYRANS JAMES ROBINSON LTD (GB) 2002-05-29 EP disclosed
US-6387512-B1 FOR COLORING INKS, FUELS, PLASTICS OR GLASS JAMES ROBINSON LIMITED (GB) 2002-05-14 US disclosed
EP-1140892-A1 PHOTOCHROMIC SUBSTIITUTED 2H-NAPHTHO[1,2-B]PYRANS JAMES ROBINSON LIMITED (GB) 2001-10-10 EP 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
EP-0540690-B1 PHOTOCHROMIC CHROMENE COMPOUNDS PPG INDUSTRIES INC (US) 1996-05-29 EP disclosed
EP-0540690-A1 PHOTOCHROMIC CHROMENE COMPOUNDS. PPG INDUSTRIES INC (US) 1993-05-12 EP disclosed
US-5200116-A Which experience a reversible change from colorless to orange upon exposure to sunlight PPG INDUSTRIES, INC. (US) 1993-04-06 US disclosed
EP-0540690-A4 PHOTOCHROMIC CHROMENE COMPOUNDS. PPG INDUSTRIES INC (US) 1993-02-12 EP disclosed
WO-1992001959-A1 PHOTOCHROMIC CHROMENE COMPOUNDS PPG INDUSTRIES, INC. (US) 1992-02-06 WO disclosed