SCHEMBL9836010

SCHEMBL9836010

O=C(O)C(Br)Oc1ccc2c(=O)c3ccccc3oc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.59
NPC1 O15118 3/20 0.59
RAB9A P51151 2/20 0.59
TTR P02766 2/20 0.56
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
KDM4E B2RXH2 2/20 0.52
ALDH1A1 P00352 2/20 0.52
HPGD P15428 2/20 0.52
HSD17B10 Q99714 2/20 0.52
TP53 P04637 1/20 0.52
CYP2C9 P11712 1/20 0.52
PTGER1 P34995 1/20 0.52
PTGER3 P43115 1/20 0.52
PTGER2 P43116 1/20 0.52
PTGDR Q13258 1/20 0.52
POLB P06746 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GLA P06280 1/20 0.49
CYP3A4 P08684 1/20 0.49

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
SCHEMBL9834510 0.84 MAOA (0.59) MAOANPC1RAB9ATTRMEN1
SCHEMBL9834780 0.84 ALDH1A1 (0.64) MAOANPC1RAB9ATTRMEN1
SCHEMBL10868440 0.81 MAOA (0.56) MAOANPC1RAB9ATTRMEN1
SCHEMBL10611335 0.77 NPC1 (0.82) MAOANPC1RAB9ATTRMEN1
SCHEMBL9837487 0.77 LMNA (0.72) MAOANPC1RAB9ATTRKMT2A
SCHEMBL7328681 0.76 NPC1 (0.68) MAOANPC1RAB9ATTRMEN1
SCHEMBL789950 0.75 MAOA (1.00) MAOANPC1RAB9AMEN1KMT2A
SCHEMBL29958722 0.75 MAOA (1.00) MAOANPC1RAB9AMEN1KMT2A
SCHEMBL23519212 0.75 MAOA (0.58) MAOANPC1RAB9ATTRMEN1
SCHEMBL7337770 0.74 MAOA (0.57) MAOANPC1RAB9AACSL1ACSL6

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
EP-0175376-B1 XANTHONE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME Chugai Seiyaku Kabushiki Kaisha (JP) 1991-04-03 EP disclosed