SCHEMBL8978512

SCHEMBL8978512

COC(=O)c1c2c(c3ccccc3c1C)OC(c1ccc(OC)cc1)(c1ccc(OC)cc1)C=C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CYP2C19 P33261 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TP53 P04637 2/20 0.34
THRB P10828 1/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
NR4A2 P43354 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL10102254 0.97 ATM (0.39) ATML3MBTL1TDP1CA1CA2
SCHEMBL17929226 0.95 ATM (0.38) ATML3MBTL1TDP1CA1CA2
SCHEMBL21452904 0.92 ATM (0.42) ATML3MBTL1TDP1CA1CA2
SCHEMBL10102251 0.91 SMN1; SMN2 (0.37) ATML3MBTL1TDP1SMN1; SMN2MEN1
SCHEMBL7608091 0.91 SMN1; SMN2 (0.41) L3MBTL1SMN1; SMN2HTTMEN1KMT2A
SCHEMBL6172997 0.91 PLA2G2A (0.38) ATML3MBTL1TDP1CA1CA2
SCHEMBL5178231 0.90 L3MBTL1 (0.38) ATML3MBTL1TDP1CA1CA2
SCHEMBL6169861 0.89 ATM (0.41) ATML3MBTL1TDP1CA1CA2
SCHEMBL29565080 0.89 ATM (0.41) ATML3MBTL1TDP1CA1CA2
SCHEMBL1408896 0.89 ATM (0.41) ATML3MBTL1TDP1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5458814-A Ophthalmic lenses TRANSITIONS OPTICAL, INC. (US) 1995-10-17 US claimed
WO-1995016215-A1 NOVEL SUBSTITUTED NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 1995-06-15 WO claimed
US-5573712-A PHOTOCHROMIC ARTICLE COMPRISING ORGANIC HOST AND THE PHOTOCHROMIC NAPHTHOPYRAN TRANSITIONS OPTICAL, INC. (US) 1996-11-12 US disclosed
US-5458814-A Ophthalmic lenses TRANSITIONS OPTICAL, INC. (US) 1995-10-17 US disclosed