SCHEMBL11276491

SCHEMBL11276491

CCC(=O)SCC(=O)N(c1c(C)ccc(Cl)c1C)[C@@H](C)C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
HTT P42858 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
PLA2G1B P04054 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39
RORC P51449 1/20 0.39
ALDH1A1 P00352 6/20 0.33
MAPT P10636 4/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
HPGD P15428 4/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
LMNA P02545 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
PKM P14618 1/20 0.32

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
SCHEMBL11276488 1.00 KMT2A (0.39) KMT2AMEN1HTTNPSR1PLA2G1B
SCHEMBL11276034 0.93 KMT2A (0.37) KMT2AMEN1HTTNPSR1PLA2G1B
SCHEMBL11276049 0.93 KMT2A (0.37) KMT2AMEN1HTTNPSR1PLA2G1B
SCHEMBL11273887 0.92 MEN1 (0.41) KMT2AMEN1HTTNPSR1PLA2G1B
SCHEMBL11273889 0.92 MEN1 (0.41) KMT2AMEN1HTTNPSR1PLA2G1B
SCHEMBL11278296 0.92 MEN1 (0.36) KMT2AMEN1HTTNPSR1PLA2G1B
SCHEMBL11278291 0.92 MEN1 (0.36) KMT2AMEN1HTTNPSR1PLA2G1B
SCHEMBL11273961 0.91 MEN1 (0.38) KMT2AMEN1HTTNPSR1PLA2G1B
SCHEMBL11282913 0.91 MEN1 (0.38) KMT2AMEN1HTTNPSR1PLA2G1B
SCHEMBL11273956 0.91 MEN1 (0.38) KMT2AMEN1HTTNPSR1PLA2G1B

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