SCHEMBL9011055

SCHEMBL9011055

O=C(O)C(CCc1ccccc1)N1CCN(C(=O)c2cccc3ccccc23)CC1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 1/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
ALDH1A1 P00352 2/20 0.51
LMNA P02545 1/20 0.51
TGM2 P21980 2/20 0.51
GAA P10253 1/20 0.48
USP2 O75604 1/20 0.48
POLB P06746 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL9011209 0.88 AVPR1A (0.57) AVPR1AMEN1KMT2AALDH1A1LMNA
SCHEMBL7811811 0.83 ALDH1A1 (0.53) AVPR1AMEN1KMT2AALDH1A1LMNA
SCHEMBL7813987 0.81 ALDH1A1 (0.55) AVPR1AMEN1KMT2AALDH1A1LMNA
SCHEMBL9010991 0.80 NPC1 (0.62) MEN1KMT2AALDH1A1LMNAGAA
SCHEMBL9011215 0.80 AVPR1A (0.53) AVPR1AMEN1KMT2AALDH1A1LMNA
SCHEMBL4453090 0.78 ALDH1A1 (0.77) AVPR1AMEN1KMT2AALDH1A1LMNA
SCHEMBL8522108 0.78 FNTA (0.49) AVPR1AMEN1KMT2AALDH1A1LMNA
SCHEMBL9011033 0.77 AVPR1A (0.55) AVPR1AMEN1KMT2AALDH1A1LMNA
SCHEMBL23013629 0.75 LMNA (0.53) ALDH1A1LMNAGAA
SCHEMBL3582934 0.75 ALDH1A1 (0.68) AVPR1AMEN1KMT2AALDH1A1LMNA

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
CN-1035178-C Arylamide derivatives SS PHARMACEUTICAL CO (JP) 1997-06-18 CN 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