SCHEMBL11601795

SCHEMBL11601795

CC(C)Oc1cccc(C(=O)Nc2ccccc2)c1I

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 6/20 0.56
KCNK9 Q9NPC2 6/20 0.56
KMT2A Q03164 3/20 0.54
RXFP1 Q9HBX9 2/20 0.54
MEN1 O00255 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
HPGD P15428 2/20 0.50
HTR2A P28223 1/20 0.50
TSPO P30536 1/20 0.50
GPR183 P32249 1/20 0.50
APLNR P35414 1/20 0.50
SGMS2 Q8NHU3 1/20 0.49
IRAK4 Q9NWZ3 1/20 0.49
ALDH1A1 P00352 1/20 0.49
PNLIP P16233 1/20 0.48
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
HTT P42858 1/20 0.47
HSD17B10 Q99714 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
SCHEMBL1441426 0.84 KCNK3 (0.60) KCNK3KCNK9KMT2ARXFP1MEN1
SCHEMBL2532202 0.82 IRAK4 (0.53) KCNK3KCNK9KMT2ARXFP1MEN1
SCHEMBL8535595 0.80 KCNK3 (0.62) KCNK3KCNK9KMT2ARXFP1HPGD
SCHEMBL28994974 0.79 HPGD (0.74) KCNK3KCNK9KMT2AMEN1TDP1
SCHEMBL31311158 0.77 KCNK3 (0.72) KCNK3KCNK9KMT2ARXFP1MEN1
SCHEMBL27493749 0.77 MEN1 (0.77) KMT2ARXFP1MEN1TDP1HPGD
SCHEMBL11458980 0.76 KMT2A (0.60) KCNK3KCNK9KMT2ARXFP1MEN1
SCHEMBL4941745 0.75 TAS1R3 (0.52) KCNK3KCNK9KMT2ARXFP1MEN1
SCHEMBL29493484 0.74 SGMS2 (0.56) KCNK3KCNK9KMT2AMEN1HPGD
SCHEMBL28995015 0.74 KMT2A (0.64) KMT2AMEN1TDP1HPGDALDH1A1

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
US-4069335-A BENZANILIDES, FUNGICIDES KUMIAL CHEMICAL INDUSTRY CO., LTD. (JA) 1978-01-17 US claimed