SCHEMBL4438630

SCHEMBL4438630

COc1ccc(C(=O)Nc2ccc(C(C)(C)C(N)=O)cc2)cc1OC.COc1ccc(C(=O)Nc2ccc(C(C)(C)CCNC(C)=O)c(-c3cccnc3)c2)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
MAPT P10636 2/20 0.48
ABL1 P00519 1/20 0.47
PTAFR P25105 3/20 0.46
ABCB1 P08183 1/20 0.46
MKNK1 Q9BUB5 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44
HPSE Q9Y251 1/20 0.44
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
PKM P14618 1/20 0.42
USP2 O75604 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SMPD1 P17405 1/20 0.41
NAMPT P43490 1/20 0.41
POLB P06746 2/20 0.41
GAA P10253 1/20 0.41
CYP3A4 P08684 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
SCHEMBL2816730 0.93 LMNA (0.55) LMNAMAPTABL1PTAFRABCB1
SCHEMBL4438631 0.93 LMNA (0.48) LMNAMAPTABL1PTAFRABCB1
SCHEMBL4446522 0.93 LMNA (0.49) LMNAMAPTABL1PTAFRABCB1
SCHEMBL2820320 0.85 LMNA (0.57) LMNAMAPTABL1PTAFRABCB1
SCHEMBL2813789 0.78 MEN1 (0.54) MAPTALDH1A1MEN1KMT2APKM
SCHEMBL2814650 0.76 LMNA (0.60) LMNAMAPTABL1ABCB1MKNK1
SCHEMBL2814444 0.75 KMT2A (0.62) MAPTALDH1A1MEN1KMT2APKM
SCHEMBL2816590 0.72 LMNA (0.62) LMNAMAPTABL1ALDH1A1MEN1
SCHEMBL4434820 0.71 MAPT (0.42) LMNAMAPTABL1PTAFRABCB1
SCHEMBL2624787 0.70 LMNA (0.78) LMNAMAPTABL1ABCB1MKNK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2134676-A2 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE Addex Pharma SA (CH) 2009-12-23 EP claimed
WO-2008117175-A2 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE ADDEX PHARMA SA (CH) 2008-10-02 WO claimed