Dimebutic Acid

Dimebutic Acid

SCHEMBL7463565

CCC(C)(C)C(=O)O.Clc1ccccc1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 8/20 0.47
PPARA Q07869 3/20 0.45
PPARG P37231 1/20 0.45
TSHR P16473 1/20 0.44
PTGES2 Q9H7Z7 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPT P10636 1/20 0.43
CYP2C19 P33261 1/20 0.43
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
CYP2C9 P11712 1/20 0.40

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
Pivalate SCHEMBL27380361 0.81 TSHR (0.55) PPARAPPARGTSHRMEN1KMT2A
Chlorobenzene SCHEMBL11539353 0.79 TSHR (0.52) RIPK1PPARAPPARGTSHRMEN1
Dimebutic Acid SCHEMBL47533 0.78
Chlorobenzene SCHEMBL11001235 0.77 TSHR (0.50) PPARAPPARGTSHRMEN1KMT2A
Chlorobenzene SCHEMBL6906848 0.76 TSHR (0.55) TSHRKMT2ACYP1A2MAPTCYP2C19
Chlorobenzene SCHEMBL27460518 0.76 TSHR (0.55) TSHRKMT2ACYP1A2MAPTCYP2C19
Dimebutic Acid SCHEMBL25275531 0.75
Dimebutic Acid SCHEMBL1962006 0.75
Dimebutic Acid SCHEMBL20139427 0.75
Dimebutic Acid SCHEMBL1055427 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0724586-B1 PROCESS FOR PREPARING N-(2,6-DICHLORO-3-METHYLPHENYL)-5-7-DIHALO[1,2,4]TRIAZOLO[1,5A]PYRIMIDINE-2-SULFONAMIDE BY CYCLIZATION AND HALO-DEHYDROXYLATION DOW AGROSCIENCES LLC (US) 2002-01-23 EP claimed