SCHEMBL4386516

SCHEMBL4386516

CC(=O)c1cccc(NC(=O)Oc2cc(=O)oc3ccccc23)c1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.57
CYP1A2 P05177 1/20 0.56
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HIF1A Q16665 1/20 0.49
TP53 P04637 1/20 0.49
TSHR P16473 1/20 0.49
PTGS2 P35354 2/20 0.47
HPGD P15428 2/20 0.46
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL29468148 0.74 KMT2A (0.68) KMT2AMEN1ALDH1A1TP53TSHR
SCHEMBL4397568 0.74 MEN1 (0.51) KMT2AMEN1ALDH1A1TP53TSHR
SCHEMBL74955 0.73 ALDH1A1 (0.59) KMT2AMEN1ALDH1A1TP53TSHR
SCHEMBL7352567 0.71 CA12 (0.53) KMT2AMEN1ALDH1A1TP53TSHR
SCHEMBL24523066 0.71 ALDH1A1 (0.59) KMT2AMEN1ALDH1A1TP53TSHR
SCHEMBL18826397 0.71 ALDH1A1 (0.59) KMT2AMEN1ALDH1A1TP53TSHR
SCHEMBL24523050 0.71 ALDH1A1 (0.59) KMT2AMEN1ALDH1A1TP53TSHR
SCHEMBL2096845 0.70 CYP1A2 (0.69) CYP1A2KMT2AMEN1ALDH1A1HPGD
SCHEMBL10832914 0.70 CYP1A2 (0.53) CYP1A2KMT2AMEN1ALDH1A1HPGD
SCHEMBL10439393 0.69 CYP1A2 (0.86) CYP1A2KMT2AMEN1ALDH1A1TP53

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
US-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed