SCHEMBL7845532

SCHEMBL7845532

CCOC(=O)C1(Cc2cccc(CN)c2)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.52
KMT2A Q03164 9/20 0.52
ALDH1A1 P00352 3/20 0.51
MAPT P10636 3/20 0.51
L3MBTL1 Q9Y468 3/20 0.50
LMNA P02545 3/20 0.48
HTT P42858 2/20 0.46
POLB P06746 2/20 0.46
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46
KDM4E B2RXH2 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL7840611 0.90 PKM (0.52) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL22789557 0.89 MEN1 (0.53) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL22309108 0.88 MEN1 (0.68) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL965515 0.87 LMNA (0.62) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL7842534 0.85 KMT2A (0.48) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL7838476 0.84 MEN1 (0.54) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL7840126 0.84 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL8185447 0.84 KMT2A (0.57) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL7842531 0.83 KMT2A (0.47) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL7829838 0.83 PKLR (0.48) MEN1KMT2AALDH1A1MAPTL3MBTL1

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 5 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
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US disclosed
EP-0944388-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-09-29 EP disclosed
US-5891889-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-04-06 US disclosed
WO-1997038665-A2 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-23 WO disclosed