SCHEMBL2901223

SCHEMBL2901223

CCOC=CC(=O)OC(=O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
TSHR P16473 2/20 0.43
KMT2A Q03164 5/20 0.42
RAB9A P51151 3/20 0.42
MEN1 O00255 2/20 0.42
MAPK1 P28482 2/20 0.42
MAPT P10636 2/20 0.41
F2 P00734 1/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 2/20 0.40
GAA P10253 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
PTGS2 P35354 1/20 0.39
PLA2G7 Q13093 1/20 0.39
HIF1A Q16665 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
AKT1 P31749 1/20 0.38

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
SCHEMBL27581022 0.80 LMNA (0.56) LMNATSHRKMT2AMAPK1MAPT
SCHEMBL18838919 0.80 LMNA (0.56) LMNATSHRKMT2AMAPK1MAPT
SCHEMBL10275628 0.80 AKT1 (0.54) LMNAKMT2ARAB9AMEN1MAPK1
SCHEMBL10275631 0.80 AKT1 (0.54) LMNAKMT2ARAB9AMEN1MAPK1
SCHEMBL10439177 0.80 AKT1 (0.54) LMNAKMT2ARAB9AMEN1MAPK1
SCHEMBL1877572 0.78 ZDHHC2 (0.49) LMNAKMT2ARAB9AMEN1MAPT
SCHEMBL1877571 0.78 ZDHHC2 (0.49) LMNAKMT2ARAB9AMEN1MAPT
SCHEMBL23754765 0.78 TSHR (0.50) LMNATSHRKMT2ARAB9AMAPK1
SCHEMBL2502087 0.78 TSHR (0.50) LMNATSHRKMT2ARAB9AMAPK1
SCHEMBL8734082 0.77 ELANE (0.59) LMNAKMT2ARAB9AMEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2148677-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES Deciphera Pharmaceuticals, LLC. (US) 2010-02-03 EP disclosed
WO-2008131276-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2008-10-30 WO disclosed
US-3987051-A Method for producing 1-unsubstituted pyrazolo[3,4-b]pyridine ketones E. R. SQUIBB & SONS, INC. (US) 1976-10-19 US disclosed