SCHEMBL7811501

SCHEMBL7811501

O=C(O)CC(Oc1ccccc1)C1CCN(C(=O)c2ccc(Br)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
L3MBTL3 Q96JM7 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HTT P42858 1/20 0.46
HPGD P15428 1/20 0.45
MGLL Q99685 1/20 0.44
HSD11B1 P28845 1/20 0.44
GRM5 P41594 2/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
UBE2M P61081 1/20 0.43
DCUN1D1 Q96GG9 1/20 0.43
POLB P06746 1/20 0.42
ACHE P22303 1/20 0.42
SLC6A4 P31645 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
EPHX2 P34913 1/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 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
SCHEMBL7811522 0.92 ACHE (0.50) KMT2AL3MBTL3L3MBTL1HTTHPGD
SCHEMBL7811611 0.85 NPC1 (0.56) KMT2AL3MBTL3L3MBTL1HTTHPGD
SCHEMBL7810081 0.79 KMT2A (0.49) KMT2AHPGDPOLBSLC6A4HRH3
SCHEMBL7817608 0.78 ALDH1A1 (0.50) KMT2AHTTLMNATP53POLB
SCHEMBL7811667 0.77 KMT2A (0.47) KMT2AL3MBTL3L3MBTL1HTTHPGD
SCHEMBL7811441 0.76 MME (0.46) KMT2AHPGDPOLBSLC6A4HRH3
SCHEMBL7817804 0.75 NPC1 (0.54) L3MBTL3L3MBTL1HTTHPGDMGLL
SCHEMBL7814002 0.73 KMT2A (0.40) KMT2AHPGDPOLBSLC6A4HRH3
SCHEMBL14600382 0.69 HTT (0.66) KMT2AHTTHPGDMGLLHSD11B1
SCHEMBL7817391 0.69 MAOB (0.54) KMT2AHPGDLMNAPOLBSLC6A4

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-0607536-B1 Arylamide derivatives SS PHARMACEUTICAL CO (JP) 2001-01-24 EP disclosed
US-5532371-A SIDE EFFECT REDUCTION SS PHARMACEUTICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5411972-A Arylamide derivatives for treating hyperlipemia SS PHARMACEUTICAL CO., LTD. (JP) 1995-05-02 US disclosed
EP-0607536-A1 Arylamide derivatives SS PHARMACEUTICAL CO., LTD. (JP) 1994-07-27 EP disclosed