SCHEMBL9303846

SCHEMBL9303846

CCOC(=O)Cc1c(C)n2c3c(cc(NC=O)cc13)CCC2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
MAPK1 P28482 2/20 0.51
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
ALDH1A1 P00352 4/20 0.35
HPGD P15428 3/20 0.35
LMNA P02545 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NLRP3 Q96P20 3/20 0.34
GAA P10253 3/20 0.34
KDM4E B2RXH2 3/20 0.34
RAB9A P51151 2/20 0.34
ALOX5 P09917 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.32
TP53 P04637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
ALOX15 P16050 1/20 0.31

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
SCHEMBL9303580 0.82 MAPK1 (0.56) KMT2AMEN1MAPK1HTR2AHTR2C
SCHEMBL9302647 0.81 MAPK1 (0.55) KMT2AMEN1MAPK1HTR2AHTR2C
SCHEMBL9302744 0.78 MEN1 (0.52) KMT2AMEN1MAPK1HTR2AHTR2C
SCHEMBL9304089 0.78 MEN1 (0.52) KMT2AMEN1MAPK1HTR2AHTR2C
SCHEMBL9305955 0.77 HTR2A (0.59) KMT2AMEN1MAPK1HTR2AHTR2C
SCHEMBL9304934 0.74 HTR2A (0.55) KMT2AMEN1MAPK1HTR2AHTR2C
SCHEMBL17686297 0.69 MCL1 (0.52) KMT2AMEN1MAPK1HTR2AHTR2C
SCHEMBL9303008 0.68 MCL1 (0.54) KMT2AMEN1MAPK1HTR2AHTR2C
SCHEMBL17686287 0.66 MCL1 (0.63) KMT2AMEN1MAPK1HTR2AHTR2C
SCHEMBL8557902 0.65 KMT2A (0.45) KMT2AMEN1MAPK1HTR2AHTR2C

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
US-5324725-A Antiinflammatory agent, antiallergen KALI-CHEMIE PHARMA GMBH (DE) 1994-06-28 US disclosed