SCHEMBL4539414

SCHEMBL4539414

CCOC(=O)C1=C(C)CCN1S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
LMNA P02545 2/20 0.51
TSHR P16473 2/20 0.51
KDM4E B2RXH2 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 7/20 0.50
CYP2C9 P11712 1/20 0.48
NOD2 Q9HC29 1/20 0.46
NOD1 Q9Y239 1/20 0.46
GAA P10253 2/20 0.46
HTT P42858 1/20 0.44
MMP2 P08253 1/20 0.43
MAPT P10636 2/20 0.43
POLB P06746 2/20 0.43

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
SCHEMBL16586846 0.86 CYP2C9 (0.50) KMT2ATSHRALDH1A1CYP2C9HTT
SCHEMBL7714538 0.75 KMT2A (0.48) KMT2ALMNATSHRKDM4EL3MBTL1
SCHEMBL1495972 0.73 KMT2A (0.47) KMT2ALMNATSHRKDM4EL3MBTL1
SCHEMBL29421388 0.73 LMNA (0.50) KMT2ALMNATSHRKDM4EL3MBTL1
SCHEMBL6339486 0.71 MAPT (0.48) KMT2ALMNATSHRKDM4EL3MBTL1
SCHEMBL31728066 0.71 LMNA (0.64) KMT2ALMNATSHRKDM4EL3MBTL1
SCHEMBL14405125 0.69 KMT2A (0.50) KMT2ALMNAALDH1A1MAPTPOLB
SCHEMBL12686069 0.69 KMT2A (0.55) KMT2ALMNATSHRKDM4EL3MBTL1
SCHEMBL14719759 0.69 MMP2 (0.68) KMT2ALMNATSHRALDH1A1GAA
SCHEMBL10900999 0.68 CYP2C9 (0.71) KMT2AALDH1A1CYP2C9GAAHTT

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
WO-2009117421-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-09-24 WO disclosed
WO-2009117421-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-09-24 WO disclosed