SCHEMBL20103183

SCHEMBL20103183

CCOC(=O)C1(CCOCl)CCC(O)CC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.42
KDM4E B2RXH2 3/20 0.40
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
MAPT P10636 3/20 0.39
ATM Q13315 1/20 0.39
P4HB P07237 1/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 4/20 0.36
POLB P06746 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PKM P14618 1/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
NPY1R P25929 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
SCHEMBL5752 0.86 MAPK1 (0.55) MAPK1KDM4EKMT2AMEN1MAPT
SCHEMBL5180 0.86 MAPK1 (0.55) MAPK1KDM4EKMT2AMEN1MAPT
SCHEMBL5270 0.86 MAPK1 (0.55) MAPK1KDM4EKMT2AMEN1MAPT
SCHEMBL3815209 0.80 POLB (0.36) MAPK1KDM4EKMT2AMEN1MAPT
SCHEMBL3815212 0.80 POLB (0.36) MAPK1KDM4EKMT2AMEN1MAPT
SCHEMBL10203579 0.80 POLB (0.36) MAPK1KDM4EKMT2AMEN1MAPT
SCHEMBL11064 0.78 MAPK1 (0.48) MAPK1KDM4EKMT2AMEN1MAPT
SCHEMBL10401 0.78 MAPK1 (0.48) MAPK1KDM4EKMT2AMEN1MAPT
SCHEMBL19631749 0.78 POLB (0.35) MAPK1KDM4EKMT2AMEN1MAPT
SCHEMBL26704563 0.75 SLC6A4 (0.35) MAPK1KDM4EKMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018078005-A1 AMIDO-SUBSTITUTED AZASPIRO DERIVATIVES AS TANKYRASE INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-05-03 WO disclosed