SCHEMBL528567

SCHEMBL528567

Cc1ccc(N(Cc2cccc(NC(=O)c3ccccc3OC(F)(F)F)c2)S(C)(=O)=O)cc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 4/20 0.54
KCNK9 Q9NPC2 4/20 0.54
F2R P25116 1/20 0.52
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
RXFP1 Q9HBX9 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPK1 P28482 1/20 0.46
MAPT P10636 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ACKR3 P25106 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
LMNA P02545 1/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C19 P33261 2/20 0.44
POLB P06746 1/20 0.43
BRAF P15056 1/20 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
SCHEMBL528261 0.89 MAPK1 (0.58) KCNK3KCNK9MEN1KMT2ARXFP1
SCHEMBL528474 0.88 KCNK3 (0.53) KCNK3KCNK9MEN1KMT2ARXFP1
SCHEMBL528847 0.86 MEN1 (0.55) KCNK3KCNK9F2RMEN1KMT2A
SCHEMBL528522 0.85 MEN1 (0.52) F2RMEN1KMT2AL3MBTL1KDM4E
SCHEMBL529422 0.84 NPC1 (0.53) KCNK3KCNK9MEN1KMT2AL3MBTL1
SCHEMBL528589 0.83 MEN1 (0.52) KCNK3KCNK9F2RMEN1KMT2A
SCHEMBL528484 0.82 MEN1 (0.48) MEN1KMT2AKDM4EMAPTNPSR1
SCHEMBL529102 0.81 MAPT (0.55) MEN1KMT2AKDM4EMAPTNPSR1
SCHEMBL528112 0.81 KMT2A (0.70) KCNK3MEN1KMT2AKDM4EMAPT
SCHEMBL529028 0.81 MEN1 (0.50) MEN1KMT2AL3MBTL1KDM4EMAPT

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