SCHEMBL6792314

SCHEMBL6792314

COC(=O)c1c(O)ccc2c1C=CC(c1ccccc1)(c1ccccc1)C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 1/20 0.42
TSHR P16473 2/20 0.35
LMNA P02545 2/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
TP53 P04637 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
GPR55 Q9Y2T6 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
SCHEMBL9114805 0.93 KDM4E (0.40) CA12CA1CA2CA7CA9
SCHEMBL7453444 0.91 KDM4E (0.36) CA12CA1CA2CA7CA9
SCHEMBL7847009 0.88 CA12 (0.39) CA12CA1CA2CA7CA9
SCHEMBL7770465 0.88 LMNA (0.35) CA12CA1CA2CA7CA9
SCHEMBL7453451 0.87 MAPT (0.41) KDM4ETSHRMEN1KMT2ASMN1; SMN2
SCHEMBL7844950 0.86 KDM4E (0.36) CA12CA1CA2CA7CA9
SCHEMBL7830306 0.86 HSD17B10 (0.38) KDM4EHSD17B10LMNASMN1; SMN2RAB9A
SCHEMBL7768682 0.85 HTT (0.40) KDM4EHSD17B10TSHRLMNAMEN1
SCHEMBL9111945 0.83 NCEH1 (0.34) KDM4EHSD17B10TSHRLMNAMEN1
SCHEMBL8117763 0.83 GRK6 (0.32) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004085569-A2 PHOTOCHROMIC ARTICLES THAT ACTIVATE BEHIND ULTRAVIOLET RADIATION BLOCKING TRANSPARENCIES AND METHODS FOR PREPARATION TRANSITIONS OPTICAL, INC. (US) 2004-10-07 WO disclosed
WO-1995016215-A1 NOVEL SUBSTITUTED NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 1995-06-15 WO disclosed