SCHEMBL7974238

SCHEMBL7974238

Cc1cccc(CC2(C(=O)OCc3ccccc3)CCN(C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.47
LMNA P02545 2/20 0.45
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
TACR1 P25103 1/20 0.45
KDM1A O60341 1/20 0.45
GPR119 Q8TDV5 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAPT P10636 1/20 0.44
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
PKM P14618 1/20 0.42

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
SCHEMBL4326509 0.91 LMNA (0.51) LMNAALDH1A1MEN1KMT2ATACR1
SCHEMBL7831653 0.88 PKM (0.53) L3MBTL1LMNAALDH1A1MEN1KMT2A
SCHEMBL7831649 0.87 GPR119 (0.49) MEN1KMT2ATACR1KDM1AGPR119
SCHEMBL7841164 0.85 POLB (0.45) L3MBTL1LMNAALDH1A1MEN1KMT2A
SCHEMBL7839366 0.84 GPR119 (0.48) L3MBTL1ALDH1A1MEN1KMT2ATACR1
SCHEMBL22014536 0.84 TACR1 (0.48) ALDH1A1MEN1KMT2ATACR1GPR119
SCHEMBL965515 0.84 LMNA (0.62) L3MBTL1LMNAALDH1A1MEN1KMT2A
SCHEMBL30289438 0.83 TACR1 (0.47) MEN1KMT2ATACR1GPR119NPSR1
SCHEMBL2374896 0.82 PKM (0.55) L3MBTL1LMNAMEN1KMT2AGPR119
SCHEMBL28226580 0.82 OPRD1 (0.45) LMNAMEN1KMT2ATACR1OPRD1

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
US-6248756-B1 Inhibitors of farnesyl-protein transferase MERCK & CO., INC. 2001-06-19 US disclosed
US-5891889-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-04-06 US disclosed