SCHEMBL6063384

SCHEMBL6063384

CCCCC(=O)Oc1ccc(C(C)COS(C)(=O)=O)cc1C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.43
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
RECQL P46063 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.37
GAA P10253 1/20 0.36
TOP2A P11388 2/20 0.35
WDR5 P61964 2/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
MGLL Q99685 1/20 0.34
LDHA P00338 1/20 0.34
LDHB P07195 1/20 0.34
AKR1B1 P15121 1/20 0.34
POLM Q9NP87 1/20 0.33
POLK Q9UBT6 1/20 0.33
POLL Q9UGP5 1/20 0.33
POLH Q9Y253 1/20 0.33

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
SCHEMBL6063596 0.93 ALOX15 (0.44) ALOX15KMT2AKDM4ESMN1; SMN2GAA
SCHEMBL6063049 0.84 ALOX15 (0.47) ALOX15KMT2AKDM4EMEN1RECQL
SCHEMBL6063385 0.83 ALOX15 (0.46) ALOX15KMT2AKDM4EMEN1RECQL
SCHEMBL6063686 0.76 ALOX15 (0.49) ALOX15KMT2AKDM4EMEN1RECQL
SCHEMBL27846924 0.75 L3MBTL1 (0.54) ALOX15KMT2AKDM4EMEN1RECQL
SCHEMBL13342736 0.72 GAA (0.57) ALOX15KMT2AKDM4EMEN1RECQL
SCHEMBL249930 0.71 TYR (0.54)
SCHEMBL15557997 0.71 ALOX15 (0.59) ALOX15KMT2AKDM4EMEN1RECQL
SCHEMBL5663362 0.70 ACHE (0.35) ALOX15KMT2AKDM4EGAA
Alcohol SCHEMBL11041706 0.69 ACHE (0.42) KMT2AMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1680397-A2 NOVEL COMPOUNDS AND THEIR USE AS ANTIDIABETIC AND HYPOLIPIDEMIC AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Reddy's Laboratories Ltd. (IN) 2006-07-19 EP disclosed
WO-2005040102-A2 NOVEL COMPOUNDS AND THEIR USE AS ANTIDIABETIC AND HYPOLIPIDEMIC AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2005-05-06 WO disclosed