SCHEMBL1971303

SCHEMBL1971303

CCOC(=O)C1(F)CCN(C(=O)O)CCC1=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 9/20 0.38
OPRD1 P41143 6/20 0.38
OPRK1 P41145 6/20 0.38
SLC22A1 O15245 1/20 0.37
SLC6A4 P31645 1/20 0.37
ADRA1A P35348 1/20 0.37
KCNH2 Q12809 1/20 0.37
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
APP P05067 1/20 0.34
ALDH1A1 P00352 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL1974887 0.83 ADORA1 (0.41) L3MBTL1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL18286044 0.82 OPRM1 (0.38) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL16903376 0.81 MEN1 (0.47) MEN1KMT2AL3MBTL1APPALDH1A1
SCHEMBL19841985 0.78 OPRM1 (0.46) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL4152272 0.77 CYP2C19 (0.42) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL1868910 0.77 OPRM1 (0.40) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL7928918 0.76 CYP2C19 (0.39) OPRM1OPRD1OPRK1SLC22A1SLC6A4
SCHEMBL16925425 0.75 OPRM1 (0.47) OPRM1SLC6A4MEN1KMT2AALDH1A1
SCHEMBL2728151 0.75 ALDH1A1 (0.38) OPRM1MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL18088169 0.75 TMEM97 (0.48) MEN1KMT2AL3MBTL1APPALDH1A1

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
EP-2334677-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS Array Biopharma, Inc. (US) 2011-06-22 EP disclosed
WO-2010022076-A1 TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2010-02-25 WO disclosed