SCHEMBL7840409

SCHEMBL7840409

CCCCOC(=O)OC(=O)C1(Cc2cccc(C)c2)CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 2/20 0.42
LMNA P02545 3/20 0.41
KMT2A Q03164 7/20 0.38
MEN1 O00255 6/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ELANE P08246 2/20 0.38
OPRM1 P35372 1/20 0.38
HPGD P15428 1/20 0.38
KLK7 P49862 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SSTR1 P30872 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL7839338 0.85 CACNA1F (0.44) LMNAKMT2AMEN1MAPK1SMN1; SMN2
SCHEMBL7845341 0.81 ELANE (0.37) LMNAKMT2AMEN1L3MBTL1ELANE
Hydrochloric Acid SCHEMBL7832311 0.79 SSTR4 (0.50) SSTR4LMNAKMT2AMEN1MAPK1
SCHEMBL7841384 0.75 SSTR4 (0.50) SSTR4KMT2AMEN1SSTR1POLB
Hydrochloric Acid SCHEMBL7831467 0.74 SSTR4 (0.49) SSTR4KMT2AMEN1SSTR1POLB
SCHEMBL6190022 0.73 L3MBTL1 (0.60) SSTR4LMNAKMT2AMEN1L3MBTL1
M-Xylene SCHEMBL25415321 0.72 L3MBTL1 (0.51) LMNAKMT2AMEN1MAPK1L3MBTL1
SCHEMBL962133 0.71 OPRM1 (0.62) LMNAKMT2AMEN1MAPK1L3MBTL1
SCHEMBL7840407 0.71 OPRD1 (0.48) SSTR4LMNAKMT2AMEN1MAPK1
SCHEMBL13278520 0.69 OPRM1 (0.51) LMNAKMT2AMEN1OPRM1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944388-A4 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2001-08-16 EP disclosed
EP-0944388-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-09-29 EP disclosed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed