SCHEMBL1387238

SCHEMBL1387238

COC(=O)c1cc2c3c(ccc2cc1OC(C)=O)OC(c1ccc(OC)cc1)(c1ccc(OC)cc1OC)C=C3

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 3/20 0.34
KMT2A Q03164 3/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C19 P33261 2/20 0.33
PLA2G2A P14555 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
ACHE P22303 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 2/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HSD17B10 Q99714 1/20 0.32
BACE1 P56817 1/20 0.32
EIF4A1 P60842 1/20 0.32
NPC1 O15118 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
SCHEMBL5644893 0.90 HIF1A (0.35) HIF1AKMT2ACYP1A2CYP2C19PLA2G2A
SCHEMBL1387468 0.83 HIF1A (0.36) HIF1AKMT2ACYP2C19PLA2G2AMEN1
SCHEMBL1333813 0.78 HIF1A (0.34) HIF1ACYP1A2CYP2C19PLA2G2AALDH1A1
SCHEMBL5182208 0.78 MAPT (0.37) KMT2ACYP1A2MEN1ALDH1A1MAPT
SCHEMBL5650291 0.78 RAB9A (0.39) HIF1AKMT2AMEN1ALDH1A1MAPT
SCHEMBL5646001 0.78 MAPT (0.36) HIF1AKMT2AMEN1ALDH1A1MAPT
SCHEMBL5645939 0.77 ACHE (0.35) HIF1AKMT2APLA2G2AMEN1ALDH1A1
SCHEMBL5645944 0.77 ACHE (0.35) HIF1AKMT2APLA2G2AMEN1ALDH1A1
SCHEMBL8522688 0.77 MAPT (0.34) HIF1AKMT2APLA2G2AMEN1ALDH1A1
SCHEMBL5667048 0.76 MAPT (0.40) KMT2ACYP1A2CYP2C19MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7166357-B2 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL, INC. (US) 2007-01-23 US claimed
US-20040185268-A1 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL LIMITED (IE) 2004-09-23 US claimed
EP-0710367-B1 PHOTOCHROMIC SUBSTITUTED NAPHTHOPYRAN COMPOUNDS PPG IND OHIO INC (US) 2000-08-30 EP claimed
JP-H09505271-A 1997-05-27 JP claimed
EP-0710367-A4 1996-05-15 EP claimed
EP-0710367-A1 PHOTOCHROMIC SUBSTITUTED NAPHTHOPYRAN COMPOUNDS PPG INDUSTRIES, INC. (US) 1996-05-08 EP claimed
US-5466398-A Photochromic substituted naphthopyran compounds TRANSITIONS OPTICAL, INC. (US) 1995-11-14 US claimed
WO-1995000867-A1 PHOTOCHROMIC SUBSTITUTED NAPHTHOPYRAN COMPOUNDS PPG INDUSTRIES, INC. (US) 1995-01-05 WO claimed
US-7166357-B2 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL, INC. (US) 2007-01-23 US disclosed
US-20040185268-A1 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL LIMITED (IE) 2004-09-23 US disclosed
EP-0710367-B1 PHOTOCHROMIC SUBSTITUTED NAPHTHOPYRAN COMPOUNDS PPG IND OHIO INC (US) 2000-08-30 EP disclosed
US-5637262-A REVERSIBLE PHOTOCHROMIC DYES FOR OPHTHALMIC LENSES TRANSITIONS OPTICAL, INC. (US) 1997-06-10 US disclosed
EP-0710367-A4 1996-05-15 EP disclosed
EP-0710367-A1 PHOTOCHROMIC SUBSTITUTED NAPHTHOPYRAN COMPOUNDS PPG INDUSTRIES, INC. (US) 1996-05-08 EP disclosed
US-5466398-A Photochromic substituted naphthopyran compounds TRANSITIONS OPTICAL, INC. (US) 1995-11-14 US disclosed
WO-1995000867-A1 PHOTOCHROMIC SUBSTITUTED NAPHTHOPYRAN COMPOUNDS PPG INDUSTRIES, INC. (US) 1995-01-05 WO disclosed