SCHEMBL8429600

SCHEMBL8429600

O=C1c2ccccc2C(=O)N1c1cccc(Oc2ccc(-c3ccc(Oc4cccc(N5C(=O)c6ccccc6C5=O)c4)cc3)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.56
BRD4 O60885 1/20 0.55
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
POLB P06746 1/20 0.52
MAPK1 P28482 1/20 0.52
LPAR1 Q92633 1/20 0.51
LPAR5 Q9H1C0 1/20 0.51
LPAR3 Q9UBY5 1/20 0.51
NR1H3 Q13133 3/20 0.50
GSTP1 P09211 1/20 0.50
ALDH1A1 P00352 3/20 0.49
MAPT P10636 1/20 0.49
SCN2A Q99250 1/20 0.49
NR1H2 P55055 2/20 0.47
FFAR4 Q5NUL3 1/20 0.46
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ESR1 P03372 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
SCHEMBL10709583 0.92 BRD4 (0.64) GRM5BRD4KMT2AMEN1POLB
SCHEMBL19689370 0.88 BRD4 (0.72) GRM5BRD4KMT2AMEN1POLB
SCHEMBL20346175 0.88 BRD4 (0.63) GRM5BRD4KMT2AMEN1POLB
SCHEMBL10641093 0.86 BRD4 (0.65) GRM5BRD4KMT2AMEN1POLB
SCHEMBL22310425 0.86 BRD4 (0.61) BRD4KMT2AMEN1POLBMAPK1
SCHEMBL16597893 0.84 BRD4 (0.56) GRM5BRD4KMT2AMEN1POLB
SCHEMBL16598017 0.83 BRD4 (0.58) GRM5BRD4KMT2AMEN1POLB
SCHEMBL14010059 0.81 BRD4 (0.60) BRD4KMT2AMEN1POLBMAPK1
SCHEMBL13302880 0.81 MGLL (0.65) GRM5BRD4KMT2AMEN1NR1H3
SCHEMBL3408445 0.81 KMT2A (0.66) BRD4KMT2AMEN1NR1H3ALDH1A1

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-5892061-A REACTING A MONO- OR POLYCARBOXYLIC ACID WITH A MONO- OR POLYAMIDE IN THE PRESENCE OF A HALOIMINIUM SALT AND BASE; CATALYST SELECTIVITY MITSUI CHEMICALS, INC. (JP) 1999-04-06 US disclosed
EP-0846714-A1 Preparation process of isoimide Mitsui Chemicals, Inc. (JP) 1998-06-10 EP disclosed