SCHEMBL9484249

SCHEMBL9484249

CCC(N)c1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
TBXA2R P21731 2/20 0.57
PRMT1 Q99873 1/20 0.56
LSS P48449 1/20 0.55
ALDH1A1 P00352 7/20 0.54
PPARG P37231 2/20 0.52
TP53 P04637 1/20 0.51
GAA P10253 1/20 0.51
LMNA P02545 3/20 0.50
HTT P42858 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CA1 P00915 3/20 0.49
CA2 P00918 3/20 0.49
CA12 O43570 2/20 0.49
CA9 Q16790 2/20 0.49
CA6 P23280 1/20 0.49
CA5A P35218 1/20 0.49
CA7 P43166 1/20 0.49

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
SCHEMBL10463393 0.86 MEN1 (0.63) MEN1KMT2ATBXA2RPRMT1LSS
SCHEMBL9021038 0.84 LSS (0.65) MEN1KMT2APRMT1LSSALDH1A1
SCHEMBL9754552 0.83 MEN1 (0.84) MEN1KMT2ATBXA2RPRMT1LSS
SCHEMBL10462759 0.82 MEN1 (0.64) MEN1KMT2ATBXA2RPRMT1LSS
SCHEMBL9493082 0.81 MEN1 (0.64) MEN1KMT2ATBXA2RPRMT1LSS
SCHEMBL9484173 0.81 MEN1 (0.60) MEN1KMT2ATBXA2RPRMT1LSS
SCHEMBL9485370 0.80 MEN1 (0.58) MEN1KMT2ATBXA2RPRMT1LSS
SCHEMBL9129518 0.80 MEN1 (0.69) MEN1KMT2ATBXA2RPRMT1LSS
SCHEMBL6974335 0.79 MEN1 (0.78) MEN1KMT2ATBXA2RPRMT1LSS
SCHEMBL28897034 0.79 ALDH1A1 (0.84) MEN1KMT2ATBXA2RPRMT1LSS

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-0564499-A1 NOVEL AMINES, PROCESS FOR PRODUCING THEM AND MEDICAMENTS CONTAINING SAID COMPOUNDS. BOEHRINGER MANNHEIM GMBH (DE) 1993-10-13 EP disclosed