SCHEMBL6653014

SCHEMBL6653014

O=C(O)c1c(Cl)c(-c2ccccc2)n2c1CN(S(=O)(=O)c1cccs1)CC2

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PKM P14618 7/20 0.47
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
POLB P06746 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
RAB9A P51151 2/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 3/20 0.43
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
JAK2 O60674 1/20 0.41

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
SCHEMBL4038882 0.92 PKM (0.45) PKMTSHRMAPK1POLBMEN1
SCHEMBL4045126 0.78 KMT2A (0.38) MEN1KMT2A
SCHEMBL6632666 0.78 LMNA (0.47) PKMPOLBMEN1KMT2ARAB9A
SCHEMBL4044206 0.76 KMT2A (0.42) PKMPOLBMEN1KMT2AALDH1A1
SCHEMBL4044860 0.76 LMNA (0.43) PKMTSHRPOLB
SCHEMBL4038921 0.75 AKR1C3 (0.46) KMT2A
SCHEMBL4047940 0.74 LSS (0.37) TSHRKMT2A
SCHEMBL4043222 0.74 GBA1 (0.42) PKMPOLBMEN1KMT2AALDH1A1
SCHEMBL4041706 0.74 CSNK1E (0.42) MEN1KMT2A
SCHEMBL4041961 0.72 PKM (0.47) PKMTSHRMAPK1POLBMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1436291-A2 INDOLIZINES AS KINASE PROTEIN INHIBITORS Aventis Pharma S.A. (FR) 2004-07-14 EP disclosed
WO-2003024967-A2 INDOLIZINES AS KINASE PROTEIN INHIBITORS AVENTIS PHARMA S.A. (FR) 2003-03-27 WO disclosed