SCHEMBL7844896

SCHEMBL7844896

CCOC(=O)C1(Cc2ccnc(C)c2)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
PKM P14618 1/20 0.44
MAPT P10636 3/20 0.44
WNT3A P56704 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
POLB P06746 1/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43

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
SCHEMBL7838387 0.84 PKM (0.44) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL7841823 0.83 MEN1 (0.48) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL965515 0.83 LMNA (0.62) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL1222109 0.82 MEN1 (0.52) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL22789557 0.82 MEN1 (0.53) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL22666983 0.82 MAPT (0.62) ALDH1A1MEN1KMT2APKMMAPT
SCHEMBL7845532 0.82 MEN1 (0.52) ALDH1A1MEN1KMT2AMAPTNPSR1
SCHEMBL22309108 0.82 MEN1 (0.68) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL8185447 0.82 KMT2A (0.57) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL3355644 0.81 KMT2A (0.52) ALDH1A1MEN1KMT2APKMLMNA

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