SCHEMBL7814002

SCHEMBL7814002

O=C(O)CC(Oc1ccccc1)C1=CCN(C(=O)c2ccc(Br)cc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
SLC6A4 P31645 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
HPGD P15428 1/20 0.39
DRD1 P21728 1/20 0.39
PTGER2 P43116 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
NPC1 O15118 1/20 0.39
MME P08473 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
KCNA5 P22460 3/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
FFAR1 O14842 1/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL7811462 0.92 KCNA5 (0.43) KMT2ASLC6A4HRH3HPGDNPC1
SCHEMBL7810320 0.86 NPC1 (0.45) KMT2ASLC6A4HRH3HPGDNPC1
SCHEMBL7811215 0.80 NPC1 (0.42) KMT2AHPGDDRD1PTGER2HRH4
SCHEMBL7804350 0.79 AVPR1A (0.44) KMT2APTGER2MEN1ALDH1A1POLB
SCHEMBL7811731 0.76 NPC1 (0.43) KMT2ASLC6A4HRH3HPGDNPC1
SCHEMBL7810081 0.74 KMT2A (0.49) KMT2ASLC6A4HRH3HPGDNPC1
SCHEMBL7811441 0.74 MME (0.46) KMT2ASLC6A4HRH3HPGDNPC1
SCHEMBL7811501 0.73 KMT2A (0.47) KMT2ASLC6A4HRH3HPGDNPC1
SCHEMBL7817583 0.71 NPC1 (0.44) KMT2AHPGDNPC1GAAMAPT
SCHEMBL7810158 0.71 KCNA5 (0.47) KMT2AHPGDNPC1KCNA5GAA

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