SCHEMBL7813985

SCHEMBL7813985

CC(C)OC(=O)C(C)(C)Oc1cccc(C2=CCN(C(=O)c3ccco3)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 5/20 0.40
PKM P14618 1/20 0.40
MDM2 Q00987 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
POLB P06746 1/20 0.37
ALOX15 P16050 1/20 0.37
ATM Q13315 1/20 0.37
TSHR P16473 1/20 0.37
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MEN1 O00255 1/20 0.36

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
SCHEMBL7811217 0.88 PPARG (0.48) KMT2ACRHBPCRHR2MAPTALDH1A1
SCHEMBL7813905 0.85 ALDH1A1 (0.46) MAPTALDH1A1PPARGPPARAPOLB
SCHEMBL7804444 0.85 NAMPT (0.44) KMT2AMAPTALDH1A1PPARGPPARA
SCHEMBL7817469 0.84 NAMPT (0.44) KMT2AMAPTALDH1A1PPARGPPARA
SCHEMBL7817528 0.83 NAMPT (0.49) KMT2AMAPTALDH1A1PPARGPPARA
SCHEMBL7814015 0.83 NAMPT (0.44) KMT2AMAPTALDH1A1PPARGPPARA
SCHEMBL7811486 0.83 PPARG (0.49) KMT2AMAPTALDH1A1PPARGPPARA
SCHEMBL7809885 0.83 POLB (0.41) KMT2AMAPTALDH1A1PPARGPPARA
SCHEMBL7804294 0.82 HPGD (0.39) KMT2AMAPTALDH1A1PPARGPPARA
SCHEMBL7814038 0.82 L3MBTL1 (0.58) ALDH1A1PKMPPARGPPARAMMP2

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