SCHEMBL8300402

SCHEMBL8300402

CCOC(=O)C1(C(=O)OCC)CCNC(=O)C1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
OPRM1 P35372 4/20 0.40
TSHR P16473 1/20 0.38
BRD4 O60885 1/20 0.38
ATM Q13315 1/20 0.36
SLC22A1 O15245 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADRA1A P35348 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
KCNH2 Q12809 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL10469244 0.85 POLB (0.44) POLBOPRM1TSHRBRD4ATM
SCHEMBL336317 0.75 KDM4E (0.47) POLBOPRM1ATMOPRD1KDM4E
SCHEMBL2814112 0.74 OPRM1 (0.54) POLBOPRM1SLC22A1SLC6A4ADRA1A
SCHEMBL4288590 0.74 POLB (0.41) POLBOPRM1BRD4ATMSLC22A1
SCHEMBL3147434 0.72 POLB (0.46) POLBOPRM1BRD4ATMSLC22A1
SCHEMBL24094554 0.72 OPRM1 (0.47) POLBOPRM1BRD4ATMSLC22A1
SCHEMBL18134201 0.71 ALDH1A1 (0.46) POLBOPRM1ATMSLC22A1SLC6A4
SCHEMBL69496 0.71 ALDH1A1 (0.46) POLBOPRM1ATMSLC22A1SLC6A4
SCHEMBL15624086 0.71 OPRM1 (0.38) POLBOPRM1BRD4SLC22A1SLC6A4
SCHEMBL18186029 0.71 BRD4 (0.58) POLBOPRM1TSHRBRD4ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5965578-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-10-12 US disclosed
EP-0897303-A4 1999-02-24 EP disclosed
EP-0897303-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 1999-02-24 EP disclosed
WO-1997036605-A1 INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 1997-10-09 WO disclosed
US-4965371-A Selective cyclization process WHITBY RESEARCH, INC. (US) 1990-10-23 US disclosed
US-4870173-A Lactam formation by a selective cyclization process NELSON RESEARCH & DEVELOPMENT CO. (US) 1989-09-26 US disclosed