SCHEMBL7813474

SCHEMBL7813474

O=C(O)CCOc1ccc(C2=CCN(C(=O)c3ccc4ccccc4c3)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.51
S1PR3 Q99500 1/20 0.51
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HTR1A P08908 6/20 0.47
MAPT P10636 1/20 0.46
NAMPT P43490 3/20 0.45
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
POLB P06746 1/20 0.43
ALOX15 P16050 1/20 0.43
DRD4 P21917 1/20 0.43

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
SCHEMBL7814230 0.90 PTPN7 (0.49) MEN1KMT2AHTR1AMAPTNAMPT
SCHEMBL7817509 0.89 S1PR1 (0.56) S1PR1S1PR3MEN1KMT2ANAMPT
SCHEMBL7813769 0.84 S1PR1 (0.48) S1PR1S1PR3MEN1KMT2ANAMPT
SCHEMBL7813977 0.83 S1PR1 (0.52) S1PR1S1PR3MEN1KMT2AHTR1A
SCHEMBL7811615 0.81 HTR1A (0.48) MEN1KMT2AHTR1AMAPTNAMPT
SCHEMBL7813535 0.79 LMNA (0.70) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL7817742 0.78 NPC1 (0.44) MEN1KMT2AHTR1AMAPTALDH1A1
SCHEMBL7810022 0.77 NPC1 (0.54) S1PR1MAPTNPC1HPGDLMNA
SCHEMBL7809956 0.76 PARP10 (0.52) MEN1KMT2AHTR1AALDH1A1SMN1; SMN2
SCHEMBL7810086 0.76 NPC1 (0.44) MEN1KMT2AMAPTALDH1A1NPC1

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