SCHEMBL4039302

SCHEMBL4039302

CN(CCC(=O)O)c1ccccc1CNC(=O)[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(I)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.41
PTGER3 P43115 1/20 0.38
TP53 P04637 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ATM Q13315 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
GNRHR P30968 1/20 0.35
ALDH1A1 P00352 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
POLB P06746 1/20 0.35
PLA2G1B P04054 1/20 0.35
PKM P14618 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL4841917 0.93 LMNA (0.39) LMNAPTGER3TP53L3MBTL1TDP1
SCHEMBL4035782 0.84 PKM (0.39) LMNATP53L3MBTL1ATMKMT2A
SCHEMBL4030551 0.83 LMNA (0.40) LMNAPTGER3TP53L3MBTL1TDP1
SCHEMBL28798992 0.79 LMNA (0.36) LMNATDP1POLB
SCHEMBL4842879 0.78 LMNA (0.40) LMNAPTGER3TP53L3MBTL1TDP1
SCHEMBL4562101 0.77 KMT2A (0.42) LMNAPTGER3TP53L3MBTL1TDP1
SCHEMBL4844911 0.77 MEN1 (0.46) LMNAPTGER3RAB9AKMT2AALDH1A1
SCHEMBL4842372 0.75 LMNA (0.48) LMNAPTGER3KMT2AALDH1A1NPSR1
SCHEMBL4036300 0.74 LMNA (0.50) LMNAPTGER3TP53L3MBTL1TDP1
SCHEMBL4036560 0.74 TRPA1 (0.45) LMNATP53

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-1885695-B8 INDOLINE COMPOUNDS FOURNIER LAB SA (FR) 2009-08-12 EP disclosed
EP-1885695-B1 INDOLINE COMPOUNDS FOURNIER LAB SA (FR) 2009-02-25 EP disclosed
EP-1885695-A2 NOVEL INDOLINE COMPOUNDS LABORATOIRES FOURNIER S.A. (FR) 2008-02-13 EP disclosed
WO-2007000550-A2 NOVEL INDOLINE COMPOUNDS LABORATOIRES FOURNIER S.A. (FR) 2007-01-04 WO disclosed