SCHEMBL9406972

SCHEMBL9406972

C=CCOc1ccccc1OC(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
CYP3A4 P08684 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MAPT P10636 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
LIG1 P18858 1/20 0.51
SLC6A3 Q01959 1/20 0.47
LMNA P02545 2/20 0.47
METAP2 P50579 1/20 0.47
METAP1 P53582 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HSD17B10 Q99714 2/20 0.46
GAA P10253 2/20 0.46
TSHR P16473 2/20 0.46
JAK2 O60674 1/20 0.46
USP2 O75604 1/20 0.46
ESR1 P03372 1/20 0.46
ALOX15 P16050 1/20 0.46

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
SCHEMBL10611396 0.98 KMT2A (0.53) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL10611401 0.98 KMT2A (0.53) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL9278150 0.89 LIG1 (0.48) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL17394439 0.87 KMT2A (0.46) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL29168888 0.85 LIG1 (0.55) KMT2AMEN1CYP3A4LIG1LMNA
SCHEMBL29168887 0.83 LIG1 (0.57) KMT2AMEN1CYP3A4LIG1LMNA
SCHEMBL9406974 0.81 PARP10 (0.54) KMT2AMEN1TDP1L3MBTL1MAPT
SCHEMBL28903793 0.81 PTGDR2 (0.47) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL29023340 0.81 FFAR1 (0.46) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL725404 0.80 KMT2A (0.76) KMT2AMEN1TDP1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0445629-B1 Process of preparing liquid crystal compositions containing multiple oriented mesogens HERCULES INC (US) 1994-09-21 EP disclosed
US-5073294-A Liquid crystal polymers HERCULES INCORPORATED (US) 1991-12-17 US disclosed
EP-0445629-A2 Process of preparing liquid crystal compositions containing multiple oriented mesogens HERCULES INCORPORATED (US) 1991-09-11 EP disclosed