SCHEMBL995225

SCHEMBL995225

COC(=O)C(CN)N1CCN(C(=O)O)CC1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 2/20 0.32
POLB P06746 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
GFER P55789 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRK1 P41145 1/20 0.31
OPRL1 P41146 1/20 0.31
TP53 P04637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NPY2R P49146 1/20 0.30
CASP6 P55212 1/20 0.30

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
SCHEMBL13958211 0.81 RECQL (0.34) MEN1KMT2APOLB
Hydrochloric Acid SCHEMBL2681973 0.81 MEN1 (0.44) ALDH1A1MEN1LMNAKMT2AL3MBTL1
SCHEMBL7935850 0.81 MEN1 (0.44) ALDH1A1MEN1LMNAKMT2AL3MBTL1
SCHEMBL2682079 0.81 MEN1 (0.44) ALDH1A1MEN1LMNAKMT2AL3MBTL1
Hydrochloric Acid SCHEMBL2680414 0.79 ALDH1A1 (0.46) ALDH1A1MEN1LMNAKMT2AL3MBTL1
Hydrochloric Acid SCHEMBL1504844 0.79 KDM4E (0.36) ALDH1A1MEN1LMNAKMT2AKDM4E
SCHEMBL1503579 0.78 NPSR1 (0.45) ALDH1A1LMNAKMT2APOLBCYP3A4
SCHEMBL28794891 0.78 ADAM17 (0.44) ALDH1A1MEN1KMT2ATP53
Hydrochloric Acid SCHEMBL1503547 0.77 ALDH1A1 (0.44) ALDH1A1LMNAKMT2ACYP3A4CYP2C19
Hydrochloric Acid SCHEMBL2682302 0.77 ALDH1A1 (0.44) ALDH1A1LMNAKMT2ACYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2801568-A1 Benzene-sulphonamide compounds, method for synthesising and use in medicine and in cosmetics Galderma Research & Development (FR) 2014-11-12 EP disclosed
EP-2448920-B1 Benzenesulfonamide compounds, method for synthesizing same, and use thereof in medicine GALDERMA RES & DEV (FR) 2014-08-13 EP disclosed
EP-2448920-A1 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS Galderma Research & Development (FR) 2012-05-09 EP disclosed
WO-2011001089-A1 NOVEL BENZENESULFONAMIDE COMPOUNDS, METHOD FOR SYNTHESIZING SAME, AND USE THEREOF IN MEDICINE AS WELL AS IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-01-06 WO disclosed