SCHEMBL29150792

SCHEMBL29150792

C=C(C)C(=O)N(c1ccc(Cl)cc1)S(=O)(=O)c1ccccc1C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TP53 P04637 4/20 0.45
MAPT P10636 6/20 0.43
HCRTR2 O43614 1/20 0.40
KMT2A Q03164 1/20 0.39
HSD11B1 P28845 1/20 0.38
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37
FLT1 P17948 1/20 0.36
FLT4 P35916 1/20 0.36
KDR P35968 1/20 0.36
THRB P10828 1/20 0.36
KCNJ6 P48051 1/20 0.36
KCNJ5 P48544 1/20 0.36
KCNJ3 P48549 1/20 0.36

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
SCHEMBL29150842 0.89 HCRTR2 (0.50) LMNAKDM4ETP53MAPTHCRTR2
SCHEMBL29150850 0.89 KMT2A (0.43) HCRTR2KMT2AHSD11B1POLBHPGD
SCHEMBL29150799 0.87 HCRTR2 (0.40) LMNAKDM4EMAPTHCRTR2KMT2A
SCHEMBL29150833 0.86 HSD11B1 (0.44) LMNATP53HCRTR2KMT2AHSD11B1
SCHEMBL29150815 0.85 TP53 (0.48) LMNATP53MAPTKMT2AHPGD
SCHEMBL29150830 0.84 HCRTR2 (0.38) HCRTR2KMT2AHSD11B1KCNJ6KCNJ5
SCHEMBL28293334 0.82 TP53 (0.47) LMNAKDM4ETP53MAPTHCRTR2
SCHEMBL29150838 0.76 HSD11B1 (0.41) LMNAKMT2AHSD11B1HPGD
SCHEMBL29001236 0.75 LMNA (0.41) LMNAKDM4ETP53MAPTHCRTR2
SCHEMBL30354433 0.74 HSP90AA1 (0.43) LMNAKDM4EMAPTKMT2A

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
CN-115947665-A Synthetic method of alpha-aryl-beta-chloroamide 湘潭大学 2023-04-11 CN disclosed