SCHEMBL4963261

SCHEMBL4963261

CCOc1ccc2c(=O)[nH]c(=O)oc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
KDM4E B2RXH2 4/20 0.55
HPGD P15428 3/20 0.55
GAA P10253 1/20 0.55
CYP1A2 P05177 2/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA4 P22748 1/20 0.51
CA6 P23280 1/20 0.51
CA5A P35218 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
CA5B Q9Y2D0 1/20 0.51
MAPT P10636 5/20 0.50
HSD17B10 Q99714 3/20 0.50
ESR2 Q92731 1/20 0.50
PARP15 Q460N3 1/20 0.50
PARP10 Q53GL7 1/20 0.50
TNKS2 Q9H2K2 1/20 0.50

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
SCHEMBL4958337 0.88 CA12 (0.54) ALDH1A1KDM4EHPGDGAACA12
SCHEMBL14262265 0.88 KDM4E (0.44) ALDH1A1KDM4EHPGDGAACA12
SCHEMBL14262271 0.85 IGLV6-57 (0.42) ALDH1A1KDM4EHPGDGAACYP1A2
SCHEMBL4958390 0.85 HDAC1 (0.51) ALDH1A1KDM4EHPGDGAACA12
SCHEMBL14262266 0.84 HDAC1 (0.52) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL2284104 0.83 KDM4E (0.57) ALDH1A1KDM4EHPGDGAACA12
SCHEMBL14262263 0.82 CA12 (0.54) ALDH1A1KDM4EHPGDCA12CA1
SCHEMBL14262269 0.81 ALDH1A1 (0.59) ALDH1A1KDM4EHPGDGAACYP1A2
SCHEMBL13949362 0.81 KMT2A (0.55) ALDH1A1KDM4EHPGDGAACYP1A2
SCHEMBL15003206 0.79 CYP1A2 (0.62) ALDH1A1KDM4EHPGDGAACYP1A2

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
US-7348296-B2 Binders for use in the thermosensitive elements of substantially light-insensitive thermographic recording materials AGFA HEALTHCARE (BE) 2008-03-25 US disclosed
US-7348296-B2 Binders for use in the thermosensitive elements of substantially light-insensitive thermographic recording materials AGFA HEALTHCARE (BE) 2008-03-25 US disclosed
US-7348296-B2 Binders for use in the thermosensitive elements of substantially light-insensitive thermographic recording materials AGFA HEALTHCARE (BE) 2008-03-25 US disclosed
US-20050003315-A1 Binders for use in the thermosensitive elements of substantially light-insensitive thermographic recording materials AGFA-GEVAERT (BE) 2005-01-06 US disclosed
US-20050003298-A1 Binders for use in the thermosensitive elements of substantially light-insensitive thermographic recording materials AGFA-GEVAERT (BE) 2005-01-06 US disclosed