SCHEMBL11265319

SCHEMBL11265319

COC(=O)CN(C(=O)CSC(=O)c1ccccc1)c1c(C)ccc(Br)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.43
ALDH1A1 P00352 5/20 0.37
MAPT P10636 2/20 0.37
GPR139 Q6DWJ6 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
PRNP P04156 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HTT P42858 2/20 0.34
MAPK1 P28482 2/20 0.33
RXFP1 Q9HBX9 2/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
GAA P10253 1/20 0.32
MEN1 O00255 2/20 0.32
MLYCD O95822 1/20 0.31

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
SCHEMBL11270268 0.91 KMT2A (0.46) KMT2AALDH1A1MAPTGPR139L3MBTL1
SCHEMBL11292441 0.89 KMT2A (0.46) KMT2AALDH1A1MAPTGPR139L3MBTL1
SCHEMBL11270244 0.87 KMT2A (0.43) KMT2AALDH1A1MAPTGPR139L3MBTL1
SCHEMBL11276183 0.87 KMT2A (0.48) KMT2AALDH1A1MAPTGPR139L3MBTL1
SCHEMBL11266992 0.85 RAB9A (0.34) ALDH1A1MAPK1RXFP1HPGDALOX15
SCHEMBL11270955 0.84 LMNA (0.35) KMT2AALDH1A1MAPTL3MBTL1KDM4E
SCHEMBL11279654 0.84 KMT2A (0.36) KMT2AALDH1A1MAPTKDM4EHPGD
SCHEMBL11281203 0.84 RAB9A (0.35) KMT2AALDH1A1MAPK1RXFP1HPGD
SCHEMBL11279726 0.83 RAB9A (0.32) ALDH1A1HPGDRAB9A
SCHEMBL11279572 0.83 ALDH1A1 (0.35) ALDH1A1HPGDRAB9A

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-4313957-A Pesticidal sulfur containing amides derived from aniline and the method of preparation thereof RHONE-POULENC AGROCHIMIE (FR) 1982-02-02 US disclosed