SCHEMBL7755246

SCHEMBL7755246

[CH2]CCCOC(=O)c1ccco1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.55
LMNA P02545 2/20 0.55
KMT2A Q03164 5/20 0.54
MAPT P10636 3/20 0.51
TSHR P16473 3/20 0.50
HTT P42858 1/20 0.50
MEN1 O00255 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NPSR1 Q6W5P4 1/20 0.48
NPC1 O15118 1/20 0.48
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
MAPK1 P28482 1/20 0.47
KDM4E B2RXH2 1/20 0.47
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL15256939 0.91 ALDH1A1 (0.59) ALDH1A1LMNAKMT2AMAPTTSHR
SCHEMBL31337846 0.91 ALDH1A1 (0.59) ALDH1A1LMNAKMT2AMAPTTSHR
SCHEMBL3146763 0.89 ALDH1A1 (0.57) ALDH1A1LMNAKMT2AMAPTTSHR
SCHEMBL11039202 0.87 ALDH1A1 (0.62) ALDH1A1LMNAKMT2AMAPTTSHR
SCHEMBL15999899 0.86 ALDH1A1 (0.55) ALDH1A1LMNAKMT2AMAPTTSHR
SCHEMBL2418046 0.85 KMT2A (0.65) ALDH1A1LMNAKMT2AMAPTTSHR
SCHEMBL27927664 0.83 ALDH1A1 (0.59) ALDH1A1LMNAKMT2AMAPTTSHR
SCHEMBL891541 0.83 ALDH1A1 (0.66) ALDH1A1LMNAKMT2AMAPTTSHR
SCHEMBL27782256 0.83 ALDH1A1 (0.52) ALDH1A1LMNAKMT2AMAPTTSHR
SCHEMBL11332447 0.83 ALDH1A1 (0.49) ALDH1A1LMNAKMT2AMAPTTSHR

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664782-B2 ENANTIOMERIC RESOLUTION ALBEMARLE CORP (US) 2001-02-14 EP disclosed
EP-0664784-B2 ENANTIOMERIC RESOLUTION ALBEMARLE CORP (US) 1999-09-29 EP disclosed
EP-0664782-B1 ENANTIOMERIC RESOLUTION ALBEMARLE CORP (US) 1998-03-04 EP disclosed
EP-0664783-B1 ENANTIOMERIC RESOLUTION ALBEMARLE CORP (US) 1998-02-04 EP disclosed
EP-0664781-B1 ENANTIOMERIC RESOLUTION ALBEMARLE CORP (US) 1998-01-07 EP disclosed
EP-0664784-B1 ENANTIOMERIC RESOLUTION ALBEMARLE CORP (US) 1997-04-16 EP disclosed
US-5442117-A Enantiomeric resolution ALBEMARLE CORPORATION (US) 1995-08-15 US disclosed
EP-0664781-A1 ENANTIOMERIC RESOLUTION ALBEMARLE CORPORATION (US) 1995-08-02 EP disclosed
EP-0664782-A1 ENANTIOMERIC RESOLUTION ALBEMARLE CORPORATION (US) 1995-08-02 EP disclosed
EP-0664783-A1 ENANTIOMERIC RESOLUTION ALBEMARLE CORPORATION (US) 1995-08-02 EP disclosed
WO-1994008934-A1 ENANTIOMERIC RESOLUTION ALBEMARLE CORPORATION (US) 1994-04-28 WO disclosed
WO-1994008936-A1 ENANTIOMERIC RESOLUTION ALBEMARLE CORPORATION (US) 1994-04-28 WO disclosed
WO-1994008935-A1 ENANTIOMERIC RESOLUTION ALBEMARLE CORPORATION (US) 1994-04-28 WO disclosed
WO-1994008937-A1 ENANTIOMERIC RESOLUTION ALBEMARLE CORPORATION (US) 1994-04-28 WO disclosed
US-5278337-A Enantiomeric resolution of aryl-substituted aliphatic carboxylic acids ETHYL CORPORATION (US) 1994-01-11 US disclosed
US-5260482-A Enantiomeric resolution ETHYL CORPORATION (US) 1993-11-09 US disclosed
US-5256816-A Enantiomeric resolution ETHYL CORPORATION (US) 1993-10-26 US disclosed
US-5248813-A Enantiomeric resolution ETHYL CORPORATION (US) 1993-09-28 US disclosed
US-4808620-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETIC, ANTIALLERGENS, ANTIARTHRITIC, ANTIRHEUMATIC AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-02-28 US disclosed
EP-0254241-A1 Pyrazolopyridine compounds, their preparation and use Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-01-27 EP disclosed