SCHEMBL24445873

SCHEMBL24445873

CC(=O)Oc1cc(O)cc(F)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.61
CYP4A11 Q02928 1/20 0.61
CYP3A4 P08684 2/20 0.53
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA9 Q16790 1/20 0.46
HCAR1 Q9BXC0 1/20 0.44
LMNA P02545 3/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TTR P02766 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
BACE1 P56817 2/20 0.40
CYP19A1 P11511 1/20 0.38
POLB P06746 1/20 0.37
PKM P14618 1/20 0.37
ACHE P22303 2/20 0.37

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
SCHEMBL1995396 0.87 CYP4F2 (0.69) CYP4F2CYP4A11CYP3A4LMNAMAPT
SCHEMBL14351002 0.85 CYP3A4 (0.63) CYP4F2CYP4A11CYP3A4LMNAMAPT
SCHEMBL320560 0.85 CYP3A4 (0.63) CYP4F2CYP4A11CYP3A4CA12CA1
SCHEMBL32667659 0.82 CYP4F2 (0.42) CYP4F2CYP4A11CYP3A4CA12CA1
Methoxymethane SCHEMBL29094017 0.81 CYP3A4 (0.59) CYP4F2CYP4A11CYP3A4CA12CA1
SCHEMBL16950367 0.80 CYP4F2 (0.61) CYP4F2CYP4A11CYP3A4LMNAMAPT
SCHEMBL16950366 0.78 CYP4F2 (0.59) CYP4F2CYP4A11CYP3A4CA12CA9
SCHEMBL16958028 0.78 CYP4F2 (0.59) CYP4F2CYP4A11CYP3A4LMNAMAPT
SCHEMBL903399 0.78 CYP4F2 (0.59) CYP4F2CYP4A11CYP3A4LMNAMAPT
SCHEMBL27799880 0.78 CYP4F2 (0.59) CYP4F2CYP4A11CYP3A4LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4001336-A1 POLYURETHANE, POLYURETHANE PRODUCTION METHOD, CONDUCTIVE PASTE COMPOSITION, CONDUCTIVE WIRE, AND METHOD FOR PRODUCING CONDUCTIVE WIRE Shin-Etsu Chemical Co., Ltd. (JP) 2022-05-25 EP disclosed
CN-101326161-B Novel compounds ASTRAZENECA AB 2013-04-17 CN disclosed
CN-101374804-A Substituted diphenylethers, -amines, -sulfides and -methanes for the treatment of respiratory disease ASTRAZENECA AB (SE) 2009-02-25 CN disclosed
CN-101326161-A Novel compounds ASTRAZENECA AB (SE) 2008-12-17 CN disclosed