SCHEMBL9011074

SCHEMBL9011074

O=C(O)CCC(c1ccccc1)C1CCN(C(=O)c2cccc3ccccc23)CC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
HIF1A Q16665 1/20 0.51
AVPR1A P37288 1/20 0.47
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
CHRM2 P08172 2/20 0.46
CCR5 P51681 1/20 0.45
USP2 O75604 1/20 0.44
TGM2 P21980 1/20 0.43
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
CASP3 P42574 1/20 0.43
POLB P06746 1/20 0.43
HTT P42858 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
SCHEMBL9011113 0.89 ALDH1A1 (0.53) ALDH1A1KDM4EMEN1KMT2AHIF1A
SCHEMBL7814080 0.82 ALDH1A1 (0.48) ALDH1A1KDM4EMEN1KMT2AHIF1A
SCHEMBL9010996 0.80 NPC1 (0.56) ALDH1A1LMNATSHRCHRM2USP2
SCHEMBL9011164 0.80 ALDH1A1 (0.51) ALDH1A1KDM4EMEN1KMT2AHIF1A
SCHEMBL9010986 0.76 AVPR1A (0.56) ALDH1A1KDM4EMEN1KMT2AHIF1A
SCHEMBL9011215 0.76 AVPR1A (0.53) ALDH1A1KDM4EMEN1KMT2AHIF1A
SCHEMBL9011184 0.76 ALDH1A1 (0.54) ALDH1A1KDM4EMEN1KMT2AHIF1A
SCHEMBL7817608 0.75 ALDH1A1 (0.50) ALDH1A1KDM4EMEN1KMT2AHIF1A
SCHEMBL15014095 0.74 ALDH1A1 (0.57) ALDH1A1KDM4EMEN1KMT2AHIF1A
SCHEMBL7312898 0.74 RAB9A (0.67) ALDH1A1KDM4EMEN1KMT2AHIF1A

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