SCHEMBL4058451

SCHEMBL4058451

CCOC(=O)Cc1c(C)n(-c2ccc(C(F)(F)F)cc2)c2cc(O)ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
ALOX5 P09917 1/20 0.44
KDM4E B2RXH2 4/20 0.43
MAPT P10636 4/20 0.43
HTT P42858 4/20 0.43
MAPK1 P28482 2/20 0.43
AKR1C3 P42330 1/20 0.41
GAA P10253 1/20 0.40
CLK1 P49759 1/20 0.40
GSK3B P49841 1/20 0.40
DYRK1A Q13627 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40
DYRK1B Q9Y463 1/20 0.40
PKM P14618 2/20 0.39
HPGD P15428 2/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL4067480 0.88 KMT2A (0.47) KMT2AMEN1ALOX5KDM4EMAPT
SCHEMBL4070593 0.88 HTT (0.52) KMT2AMEN1KDM4EMAPTHTT
SCHEMBL4063193 0.86 KMT2A (0.47) KMT2AMEN1KDM4EMAPTHTT
SCHEMBL4058640 0.86 HTT (0.50) KMT2AMEN1KDM4EMAPTHTT
SCHEMBL4062714 0.86 USP14 (0.52) KMT2AMEN1ALOX5KDM4EMAPT
SCHEMBL4060953 0.85 MEN1 (0.61) KMT2AMEN1KDM4EMAPTHTT
SCHEMBL4234701 0.85 KMT2A (0.53) KMT2AMEN1KDM4EMAPTHTT
SCHEMBL4063813 0.85 CLK1 (0.56) KMT2AMEN1ALOX5KDM4EMAPT
SCHEMBL4057298 0.83 USP14 (0.54) KMT2AMEN1KDM4EMAPTHTT
SCHEMBL4060871 0.82 HTT (0.52) KMT2AMEN1KDM4EMAPTHTT

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-1960777-B1 SERUM-FREE EXPANSION OF CELLS IN CULTURE CHOONGWAE PHARMA CORP (KR) 2009-10-21 EP disclosed
US-20070128669-A1 Serum-free expansion of cells in culture INSTITUTE FOR CHEMICAL GENOMICS (US) 2007-06-07 US disclosed