SCHEMBL6650827

SCHEMBL6650827

COc1ccc(C2(c3ccc(OC)cc3)C=Cc3c(CO[Si](C)(C)C)c(OC)c4ccccc4c3O2)cc1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HIF1A Q16665 1/20 0.30

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
SCHEMBL29565427 0.86 HIF1A (0.33) KDM4EMEN1ALDH1A1LMNACYP2C9
SCHEMBL6648587 0.86 HIF1A (0.33) KDM4EMEN1ALDH1A1LMNACYP2C9
SCHEMBL6649810 0.82 ALDH1A1 (0.33) KDM4EALDH1A1HSD17B10HIF1A
SCHEMBL1984131 0.77 EDNRA (0.33) KDM4EMEN1ALDH1A1LMNACYP2C9
SCHEMBL1845200 0.77 MEN1 (0.35) KDM4EMEN1ALDH1A1LMNACYP2C9
SCHEMBL6650937 0.75 GPR84 (0.37) KDM4EALDH1A1LMNACYP2C9HPGD
SCHEMBL6169861 0.75 ATM (0.41) KDM4EMEN1ALDH1A1LMNAHPGD
SCHEMBL29566136 0.75 GPR84 (0.37) KDM4EALDH1A1LMNACYP2C9HPGD
SCHEMBL12205494 0.74 ACHE (0.38) KDM4EMEN1ALDH1A1LMNACYP2C9
SCHEMBL8829122 0.74 AHR (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0835870-B1 Photochromic substituted naphthopyrans PPG IND OHIO INC (US) 2004-03-03 EP claimed
EP-0835870-A1 Photochromic substituted naphthopyrans PPG INDUSTRIES, INC. (US) 1998-04-15 EP claimed
EP-0835870-B1 Photochromic substituted naphthopyrans PPG IND OHIO INC (US) 2004-03-03 EP 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