SCHEMBL7734217

SCHEMBL7734217

C=C(C)C(=O)OCCCCCCOC(=O)c1cc2ccc(N(CC)CC)cc2oc1=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.69
MEN1 O00255 7/20 0.61
MAPT P10636 7/20 0.61
KMT2A Q03164 7/20 0.61
ATM Q13315 3/20 0.61
USP2 O75604 2/20 0.61
CYP1A2 P05177 1/20 0.61
CYP2C19 P33261 1/20 0.61
ALDH1A1 P00352 7/20 0.58
KDM4E B2RXH2 7/20 0.58
HPGD P15428 5/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
HSD17B10 Q99714 2/20 0.58
SLC16A3 O15427 1/20 0.58
ALOX15 P16050 1/20 0.58
SLC16A1 P53985 1/20 0.58
NPC1 O15118 1/20 0.49
STAT3 P40763 1/20 0.49
STAT1 P42224 1/20 0.49
RAB9A P51151 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
SCHEMBL13609752 0.95 MAOB (0.72) MAOBMEN1MAPTKMT2AATM
SCHEMBL13432119 0.89 MAOB (0.76) MAOBMEN1MAPTKMT2AATM
SCHEMBL13840825 0.89 MAOB (0.76) MAOBMEN1MAPTKMT2AATM
SCHEMBL7722862 0.88 MAOB (0.74) MAOBMEN1MAPTKMT2AATM
SCHEMBL17597644 0.87 MAOB (0.79) MAOBMEN1MAPTKMT2AATM
SCHEMBL17368890 0.86 MAOB (0.71) MAOBMEN1MAPTKMT2AATM
SCHEMBL9302603 0.84 KMT2A (0.61) MAOBMEN1MAPTKMT2AATM
SCHEMBL4598366 0.83 MAOB (0.80) MAOBMEN1MAPTKMT2AATM
SCHEMBL1772718 0.82 MAOB (1.00) MAOBMEN1MAPTKMT2AATM
SCHEMBL29816856 0.81 MAOB (0.80) MAOBMEN1MAPTKMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6403239-B2 MONOMER CONTAINING PHOTOLUMINESCENCE COMPOUND BAYER AG (DE) 2002-06-11 US disclosed
EP-0728754-B1 Coumarin derivatives, method for their preparation and their use as intermediates BAYER AG (DE) 2001-11-28 EP disclosed
EP-0728775-B1 (Co)polymers based on vinyl monomers and their use in electroluminescent devices BAYER AG (DE) 2001-10-04 EP disclosed
US-20010026879-A1 (Co)polymers based on vinyl units and use thereof in electroluminescent devices CHEN YUN (DE) 2001-10-04 US disclosed
US-6248457-B1 ELECTROLUMINESCENT COPOLYMER WHICH CONTAINS REPEAT UNITS WITH PHOTOLUMINESCENT RESIDUES BAYER AG (DE) 2001-06-19 US disclosed
US-5650456-A Coumarin derivatives, a method of preparing them and their use as intermediates BAYER AKTIENGESELLSCHAFT (DE) 1997-07-22 US disclosed
EP-0728754-A1 Coumarin derivatives, method for their preparation and their use as intermediates BAYER AG (DE) 1996-08-28 EP disclosed
EP-0728775-A2 (Co)polymers based on vinyl monomers and their use in electroluminescent devices BAYER AG (DE) 1996-08-28 EP disclosed