SCHEMBL7258372

SCHEMBL7258372

CCOCCOC(F)(F)C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
THRB P10828 1/20 0.36
KMT2A Q03164 1/20 0.31
HPGD P15428 2/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
CES2 O00748 1/20 0.31
GAA P10253 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL7559951 0.85 ABCB11 (0.33) KMT2AGAAKDM4E
SCHEMBL9139695 0.84 CES2 (0.42) TSHRTHRBKMT2ACES2
SCHEMBL20561057 0.81 ALDH1A1 (0.47) ALDH1A1TSHRTHRB
SCHEMBL7560874 0.81 KMT2A (0.35) ALDH1A1TSHRTHRBKMT2ANPC1
SCHEMBL7258437 0.80 ALDH1A1 (0.43) ALDH1A1TSHRTHRBCES2
SCHEMBL27547228 0.80 ALDH1A1 (0.43) ALDH1A1TSHRTHRBCES2
SCHEMBL20561060 0.78 ALDH1A1 (0.42) ALDH1A1TSHRTHRBCES2
SCHEMBL13391772 0.72 ALDH1A1 (0.43) ALDH1A1TSHRTHRBHPGDNPC1
SCHEMBL9937107 0.69 ALDH1A1 (0.56) ALDH1A1TSHRTHRBKMT2AHPGD
SCHEMBL27009189 0.69 TSHR (0.39) ALDH1A1TSHRKMT2AGAA

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-0965335-B1 Metered-dose aerosol formulations MINNESOTA MINING & MFG (US) 2003-09-17 EP disclosed
EP-0965335-A1 Metered-dose aerosol formulations MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-12-22 EP disclosed
EP-0636362-B1 The use of soluble fluorosurfactants for the preparation of metered-dose aerosol formulations MINNESOTA MINING & MFG (US) 1999-12-22 EP disclosed
EP-0526481-B1 THE USE OF SOLUBLE FLUOROSURFACTANTS FOR THE PREPARATION OF METERED-DOSE AEROSOL FORMULATIONS MINNESOTA MINING & MFG (US) 1995-04-26 EP disclosed
EP-0636362-A2 The use of soluble fluorosurfactants for the preparation of metered-dose aerosol formulations MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-02-01 EP disclosed