SCHEMBL528847

SCHEMBL528847

Cc1ccc(N(Cc2cccc(NC(=O)c3ccccc3C)c2)S(C)(=O)=O)cc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
LMNA P02545 3/20 0.52
MAPT P10636 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
POLB P06746 1/20 0.50
ALDH1A1 P00352 3/20 0.49
HPGD P15428 2/20 0.49
KDM4E B2RXH2 1/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
KCNK3 O14649 1/20 0.48
KCNK9 Q9NPC2 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
F2R P25116 2/20 0.47
GAA P10253 1/20 0.47

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
SCHEMBL528522 0.91 MEN1 (0.52) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL528589 0.91 MEN1 (0.52) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL529102 0.91 MAPT (0.55) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL528200 0.89 ALDH1A1 (0.55) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL528261 0.89 MAPK1 (0.58) MEN1KMT2AMAPTNPSR1POLB
SCHEMBL528112 0.88 KMT2A (0.70) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL529028 0.88 MEN1 (0.50) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL528474 0.88 KCNK3 (0.53) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL528567 0.86 KCNK3 (0.54) MEN1KMT2ALMNAMAPTNPSR1
SCHEMBL529422 0.86 NPC1 (0.53) MEN1KMT2ALMNAMAPTNPSR1

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
WO-2012014127-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-02-02 WO disclosed