SCHEMBL4044860

SCHEMBL4044860

Cn1cnc(S(=O)(=O)N2CCn3c(c(C(=O)O)c(Cl)c3-c3ccccc3)C2)c1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
PKM P14618 1/20 0.43
POLB P06746 1/20 0.43
SLC6A9 P48067 9/20 0.41
TSHR P16473 1/20 0.39

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
SCHEMBL4038988 0.93 LMNA (0.42) LMNAPKMPOLBSLC6A9TSHR
SCHEMBL4045126 0.77 KMT2A (0.38)
SCHEMBL6632666 0.77 LMNA (0.47) LMNAPKMPOLB
SCHEMBL6653014 0.76 PKM (0.47) PKMPOLBTSHR
SCHEMBL4044206 0.73 KMT2A (0.42) PKMPOLB
SCHEMBL4038921 0.72 AKR1C3 (0.46)
SCHEMBL4047940 0.71 LSS (0.37) TSHR
SCHEMBL4036996 0.71 SMN1; SMN2 (0.39) TSHR
SCHEMBL4043222 0.71 GBA1 (0.42) LMNAPKMPOLB
SCHEMBL4041706 0.71 CSNK1E (0.42)

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
EP-1436291-B1 INDOLIZINES AS KINASE PROTEIN INHIBITORS AVENTIS PHARMA SA (FR) 2009-01-14 EP disclosed