SCHEMBL7804342

SCHEMBL7804342

O=C(O)CCC(Oc1ccccc1)N1CCN(C(=O)c2cccc3ccccc23)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.48
HTT P42858 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
AVPR1A P37288 1/20 0.47
USP2 O75604 1/20 0.46
TGM2 P21980 2/20 0.46
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL7804359 0.90 ALDH1A1 (0.50) ALDH1A1LMNAPOLBHTTMEN1
SCHEMBL9011164 0.82 ALDH1A1 (0.51) ALDH1A1LMNAPOLBHTTMEN1
SCHEMBL7814080 0.82 ALDH1A1 (0.48) ALDH1A1LMNAPOLBHTTMEN1
SCHEMBL7804488 0.81 AVPR1A (0.54) ALDH1A1LMNAPOLBHTTMEN1
SCHEMBL7804499 0.81 TSHR (0.54) ALDH1A1LMNAPOLBHTTMEN1
SCHEMBL7817534 0.77 PTGDR (0.43) ALDH1A1LMNAPOLBHTTMEN1
SCHEMBL7811811 0.77 ALDH1A1 (0.53) ALDH1A1LMNAPOLBHTTMEN1
SCHEMBL7813501 0.77 ALDH1A1 (0.53) ALDH1A1LMNAPOLBHTTMEN1
SCHEMBL7813987 0.76 ALDH1A1 (0.55) ALDH1A1LMNAPOLBHTTMEN1
SCHEMBL4453090 0.76 ALDH1A1 (0.77) ALDH1A1LMNAPOLBHTTMEN1

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