SCHEMBL7475866

SCHEMBL7475866

O=C(CN1CCC(c2ccc(Oc3ccccc3)cc2)CC1)N[C@@H]1C[C@H]1c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 1/20 0.51
EPHX2 P34913 7/20 0.49
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 1/20 0.46
GLA P06280 1/20 0.46
KMT2A Q03164 1/20 0.46
HRH3 Q9Y5N1 1/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL7465842 0.82 DRD4 (0.46) DRD2DRD4DRD3MEN1KMT2A
SCHEMBL13898533 0.82 LMNA (0.48) EPHX2ALDH1A1MEN1GLAKMT2A
SCHEMBL7474955 0.81 ALDH1A1 (0.66) MMP3DRD2DRD4DRD3ALDH1A1
SCHEMBL13898271 0.79 EPHX2 (0.43) EPHX2DRD2DRD4DRD3ALDH1A1
SCHEMBL6161142 0.77 SIGMAR1 (0.58) MMP3ALDH1A1KMT2AHRH3LMNA
SCHEMBL7477194 0.76 DRD4 (0.59) MMP3DRD2DRD4DRD3ALDH1A1
SCHEMBL14747464 0.76 KDM1A (0.46) EPHX2SMN1; SMN2
SCHEMBL7468358 0.76 MMP3 (0.46) MMP3ALDH1A1MEN1GLAKMT2A
SCHEMBL2776191 0.76 SMN1; SMN2 (0.55) EPHX2SMN1; SMN2
SCHEMBL2776196 0.76 SMN1; SMN2 (0.55) EPHX2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757986-B1 Arylpiperidine and arylpiperazine derivatives and drugs containing the same SUNTORY LTD (JP) 2002-06-12 EP disclosed
US-5723475-A Arylpiperidine and arylpiperazine derivatives and medicament containing the same SUNTORY LIMITED (JP) 1998-03-03 US disclosed
EP-0757986-A1 ARYLPIPERIDINE AND ARYLPIPERAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-02-12 EP disclosed