SCHEMBL7839366

SCHEMBL7839366

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

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.48
KDM1A O60341 2/20 0.48
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
SSTR1 P30872 1/20 0.43
SSTR4 P31391 1/20 0.43
TACR1 P25103 1/20 0.42
PKM P14618 1/20 0.41
POLB P06746 1/20 0.41
CHRM2 P08172 1/20 0.40
CHRM3 P20309 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL7831649 0.90 GPR119 (0.49) GPR119KDM1AOPRD1OPRK1SSTR1
SCHEMBL7831653 0.88 PKM (0.53) GPR119KDM1AOPRD1OPRK1SSTR1
SCHEMBL8512562 0.87 OPRD1 (0.53) GPR119OPRD1OPRK1TACR1PKM
SCHEMBL7974238 0.84 L3MBTL1 (0.47) GPR119KDM1AOPRD1OPRK1TACR1
SCHEMBL7831085 0.83 ALDH1A1 (0.50) GPR119KDM1AOPRD1OPRK1TACR1
SCHEMBL7832576 0.82 GPR119 (0.48) GPR119KDM1AOPRD1OPRK1TACR1
SCHEMBL7832066 0.81 GPR119 (0.47) GPR119KDM1AOPRD1OPRK1SSTR1
SCHEMBL23660647 0.81 NAMPT (0.56) GPR119OPRD1OPRK1MAPTJAK2
SCHEMBL5810960 0.81 HDAC2 (0.46) KDM1AOPRD1OPRK1TACR1PKM
SCHEMBL23660675 0.81 GPR119 (0.50) GPR119OPRD1OPRK1PKMALDH1A1

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