SCHEMBL7711934

SCHEMBL7711934

O=C(O)CCCCC(=O)OC(Cc1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.49
MAPT P10636 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
HDAC3 O15379 2/20 0.47
HDAC4 P56524 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC7 Q8WUI4 2/20 0.47
HDAC2 Q92769 2/20 0.47
HDAC10 Q969S8 2/20 0.47
HDAC11 Q96DB2 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
HDAC6 Q9UBN7 2/20 0.47
HDAC9 Q9UKV0 2/20 0.47
HDAC5 Q9UQL6 2/20 0.47
MAPK1 P28482 1/20 0.47
ADRA1A P35348 1/20 0.47
SLC6A3 Q01959 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ACE P12821 1/20 0.47
KEAP1 Q14145 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
SCHEMBL1021016 0.98 MAPT (0.51) LTA4HMAPTRXFP1HDAC3HDAC4
SCHEMBL10606212 0.98 MAPT (0.51) LTA4HMAPTRXFP1HDAC3HDAC4
SCHEMBL2637707 0.90 ACE (0.53) LTA4HHDAC3HDAC4HDAC1HDAC7
SCHEMBL22542568 0.84 MAPT (0.58) MAPTRXFP1HDAC3HDAC4HDAC1
SCHEMBL1484827 0.82 EPHX1 (0.46) SMN1; SMN2ACECPA3EPHX1
SCHEMBL28133878 0.81 MGLL (0.48) MAPTRXFP1MGLL
SCHEMBL7148846 0.81 MEN1 (0.43) HDAC11FFAR1
SCHEMBL28833591 0.80 CRHBP (0.49) MAPTRXFP1HDAC3HDAC4HDAC1
SCHEMBL28850896 0.80 TSHR (0.61) MAPK1SMN1; SMN2ACEEPHX1
SCHEMBL4392102 0.80 CYSLTR2 (0.44) HDAC11FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6436691-B1 CONJUGATE WHICH IS SUBSTANTIALLY NON-IMMUNOGENIC IN HUMANS COMPRISING TARGETING MOIETY CAPABLE OF BINDING WITH TUMOR ASSOCIATED ANTIGEN LINKED TO MUTATED FORM OF CARBOXYPEPTIDASE B ENZYME CAPABLE OF CONVERTING PRODRUG INTO ANTICANCER DRUG ZENECA LIMITED (GB) 2002-08-20 US disclosed
EP-0844885-A2 CHEMICAL COMPOUNDS ZENECA LIMITED (GB) 1998-06-03 EP disclosed
WO-1997007769-A2 CHEMICAL COMPOUNDS ZENECA LIMITED (GB) 1997-03-06 WO disclosed
EP-0194808-B1 POLYESTER RESIN COMPOSITION FOR FORMING AN IMPACT RESISTANT ARTICLE UNITIKA LTD. (JP) 1989-05-17 EP disclosed
US-4659757-A POLYETHYLENE TEREPHTHALATE, ETHYLENE TEREPHTHALATE BASE POLYESTER, POLYACRYLATE; MOLDING MATERIALS UNITIKA LTD. (JP) 1987-04-21 US disclosed
EP-0194808-A1 Polyester resin composition for forming an impact resistant article UNITIKA LTD. (JP) 1986-09-17 EP disclosed