SCHEMBL18716488

SCHEMBL18716488

COCO[C@H]1C(=O)N(c2ccc(OC)cc2)C1[C@H]1COC(C)(C)O1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 10/20 0.39
L3MBTL1 Q9Y468 2/20 0.34
ALDH1A1 P00352 3/20 0.33
KMT2A Q03164 2/20 0.33
KCNH2 Q12809 1/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.33
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL18686866 1.00 HSD11B1 (0.39) HSD11B1L3MBTL1ALDH1A1KMT2AKCNH2
SCHEMBL18716489 1.00 HSD11B1 (0.39) HSD11B1L3MBTL1ALDH1A1KMT2AKCNH2
SCHEMBL4182608 0.86 HSD11B1 (0.39) HSD11B1L3MBTL1ALDH1A1KMT2AKCNH2
SCHEMBL4170321 0.84 MMP1 (0.39) HSD11B1L3MBTL1ALDH1A1KMT2ALMNA
SCHEMBL4181612 0.81 HSD11B1 (0.36) HSD11B1L3MBTL1ALDH1A1KCNH2LMNA
SCHEMBL19433531 0.81 SMN1; SMN2 (0.45) HSD11B1L3MBTL1ALDH1A1KCNH2
SCHEMBL8620053 0.81 HSD11B1 (0.40) HSD11B1L3MBTL1ALDH1A1KCNH2TSHR
SCHEMBL8870143 0.81 HSD11B1 (0.40) HSD11B1L3MBTL1ALDH1A1KCNH2TSHR
SCHEMBL8620049 0.81 HSD11B1 (0.40) HSD11B1L3MBTL1ALDH1A1KCNH2TSHR
SCHEMBL9368035 0.80 L3MBTL1 (0.40) HSD11B1L3MBTL1ALDH1A1KMT2ALMNA

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-3269721-B1 BICYCLIC PYRIDINE COMPOUND ASTELLAS PHARMA INC (JP) 2021-04-07 EP disclosed
EP-3150581-A1 PYRIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2017-04-05 EP disclosed