SCHEMBL7308739

SCHEMBL7308739

Cc1noc(C)c1COC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.61
L3MBTL1 Q9Y468 3/20 0.61
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
ATM Q13315 1/20 0.56
GAA P10253 1/20 0.55
TSHR P16473 1/20 0.53
MAPT P10636 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
POLB P06746 1/20 0.51

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
SCHEMBL14514010 0.77 ALDH1A1 (0.57) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL2172793 0.75 P2RX7 (0.49) ALDH1A1L3MBTL1KMT2AMEN1GAA
SCHEMBL791943 0.74 KDM4E (0.49) ALDH1A1L3MBTL1KMT2AMEN1ATM
Hydrochloric Acid SCHEMBL1372267 0.73 P2RX7 (0.48) ALDH1A1L3MBTL1KMT2AMEN1GAA
SCHEMBL2824162 0.73 ALDH1A1 (0.54) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL402220 0.72 GAA (0.45) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL8331718 0.72 GRIA1 (0.50) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL324249 0.72 ALDH1A1 (0.48) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL314801 0.72 MEN1 (0.45) ALDH1A1L3MBTL1KMT2AMEN1ATM
SCHEMBL20511052 0.72 GAA (1.00) ALDH1A1L3MBTL1KMT2AMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0486948-B1 Retroviral protease inhibiting compounds ABBOTT LAB (US) 2000-10-04 EP disclosed
EP-0997459-A1 Intermediates for preparing retroviral protease inhibiting compounds Abbott Laboratories (US) 2000-05-03 EP disclosed
US-5837873-A PROTECTED OXYDIAMINES ABBOTT LABORATORIES (US) 1998-11-17 US disclosed
US-5648497-A Retroviral protease inhibiting compounds ABBOTT LABORAOTRIES (US) 1997-07-15 US disclosed
US-5616714-A PYRIDYL, THIAZOLYL-SUBSTITUTED AMINO ACID DERIVATIVES ABBOTT LABORATORIES (US) 1997-04-01 US disclosed
US-5597926-A Retroviral protease inhibiting compounds ABBOTT LABORATORIES (US) 1997-01-28 US disclosed
US-5554783-A (2R, 3R, 4S, 5S)-3-ACETOXY-2,5-BIS/BENZYLOXYCARBONYLAMINO/ -4-BROMO-1,5-DIPHENYLHEXANE ABBOTT LABORATORIES (US) 1996-09-10 US disclosed
US-5541334-A TREATING HIV ABBOTT LABORATORIES (US) 1996-07-30 US disclosed
US-5354866-A Treating HIV infections ABBOTT LABORATORIES (US) 1994-10-11 US disclosed
EP-0486948-A2 Retroviral protease inhibiting compounds ABBOTT LABORATORIES (US) 1992-05-27 EP disclosed