SCHEMBL7860982

SCHEMBL7860982

CCCCCOC(=O)C(CO)C(O)(CC(=O)O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.56
BLM P54132 1/20 0.56
HSPE1 P61604 1/20 0.56
MEN1 O00255 1/20 0.45
HPGD P15428 1/20 0.45
RECQL P46063 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NAAA Q02083 1/20 0.38
CPT2 P23786 1/20 0.38
ACLY P53396 1/20 0.38
HCAR2 Q8TDS4 1/20 0.37
EPHX2 P34913 1/20 0.36
PLA2G2C Q5R387 1/20 0.36

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
SCHEMBL6050436 0.89 HSPD1 (0.57) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL2463997 0.88 HSPD1 (0.68) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL21248068 0.88 HSPD1 (0.60) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL1038854 0.88 HSPD1 (0.53) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL6288812 0.87 HSPD1 (0.71) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL1218292 0.87 HSPD1 (0.71) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL2877367 0.82 CPT2 (0.51) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL6012188 0.80 HSPD1 (0.61) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL1659505 0.78 HSPD1 (0.51) HSPD1BLMHSPE1MEN1HPGD
SCHEMBL8567937 0.77 HSPD1 (0.50) HSPD1BLMHSPE1MEN1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0759744-B1 NARCOTIC CONTAINING AEROSOL FORMULATION ARADIGM CORP (US) 2001-10-17 EP disclosed
US-5910301-A CALCULATING POINT IN PATIENT'S INSPIRATORY CYCLE AT WHICH DRUG DELIVERY IS MOST LIKELY TO BE REPRODUCIBLE, RELEASING METERED DOSE OF AEROSOLIZED FORMULATION OF NARCOTIC DISSOLVED IN LOW BOILING PROPELLANT FROM PRESSURIZED CANISTER, INHALING ARADIGM CORPORATION (US) 1999-06-08 US disclosed
EP-0759744-A4 NARCOTIC CONTAINING AEROSOL FORMULATION ARADIGM CORP (US) 1997-10-29 EP disclosed
EP-0759744-A1 NARCOTIC CONTAINING AEROSOL FORMULATION ARADIGM CORPORATION (US) 1997-03-05 EP disclosed
WO-1995031182-A1 NARCOTIC CONTAINING AEROSOL FORMULATION ARADIGM CORPORATION (US) 1995-11-23 WO disclosed