SCHEMBL7817513

SCHEMBL7817513

CC(C)OC(=O)C(C)(C)Oc1cccc(C2CCN(C(=O)c3ccco3)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 5/20 0.49
CTNNB1 P35222 5/20 0.49
RAB9A P51151 1/20 0.47
RBP4 P02753 1/20 0.46
ALDH1A1 P00352 3/20 0.43
PKM P14618 2/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 1/20 0.43
GPR119 Q8TDV5 1/20 0.43
PPARA Q07869 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 1/20 0.41

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
SCHEMBL7813798 0.88 BCL9 (0.58) BCL9CTNNB1RAB9ARBP4ALDH1A1
SCHEMBL7811643 0.85 BCL9 (0.52) BCL9CTNNB1ALDH1A1KMT2APPARA
SCHEMBL7813907 0.83 BCL9 (0.49) BCL9CTNNB1PPARA
SCHEMBL7804213 0.83 BCL9 (0.49) BCL9CTNNB1ALDH1A1KMT2APPARA
SCHEMBL7813463 0.82 BCL9 (0.48) BCL9CTNNB1KMT2APPARASMN1; SMN2
SCHEMBL7804520 0.82 HSD11B1 (0.55) BCL9CTNNB1ALDH1A1TSHR
SCHEMBL7817327 0.82 BCL9 (0.48) BCL9CTNNB1KMT2APPARASMN1; SMN2
SCHEMBL7814050 0.82 MEN1 (0.52) BCL9CTNNB1KMT2APPARASMN1; SMN2
SCHEMBL7814148 0.82 NPC1 (0.48) BCL9CTNNB1RAB9AALDH1A1KMT2A
SCHEMBL7811471 0.82 PARP10 (0.51) BCL9CTNNB1RAB9AALDH1A1KMT2A

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