SCHEMBL6256448

SCHEMBL6256448

O=C1CC(O)(O)C(c2ccccc2)O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.38
PTGS2 P35354 1/20 0.37
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPK1 P28482 1/20 0.35
HTR2B P41595 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
AR P10275 1/20 0.35
CYP19A1 P11511 1/20 0.35
MAOB P27338 1/20 0.35
HSD17B10 Q99714 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL1062160 0.78 CA2 (0.38) CA2CYP2C9CYP2C19KMT2ANPSR1
SCHEMBL23699018 0.75 MAOB (0.37) PTGS2MAPTCYP3A4MAPK1KDM4E
SCHEMBL19239671 0.70 MAOA (0.37) KMT2ANPSR1MAPTLMNAMAOB
SCHEMBL5313705 0.63 DNMT3B (0.57) CA2NPSR1MAPTLMNACYP3A4
SCHEMBL10515985 0.63 CHRNA7 (0.44) PTGS2CYP2C19KMT2ANPSR1MAPT
SCHEMBL26476248 0.63 PTGS2 (0.40) CA2PTGS2CYP2C19KMT2ANPSR1
SCHEMBL4260040 0.63 MAOB (0.60) CYP2C9CYP2C19KMT2AMAPTCYP1A2
SCHEMBL13318482 0.62 TSHR (0.39) CA2PTGS2CYP2C9CYP2C19KMT2A
SCHEMBL120709 0.61 MEN1 (0.48) CA2CYP2C9CYP2C19KMT2AMAPT
SCHEMBL7379470 0.61 MEN1 (0.48) CA2CYP2C9CYP2C19KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005052952-A1 PHOSPHOR SCREEN AND IMAGING ASSEMBLY EASTMAN KODAK COMPANY (US) 2005-06-09 WO disclosed