SCHEMBL727285

SCHEMBL727285

CC1(C)CC(=O)c2cc(OS(=O)(=O)C(F)(F)F)ccc2S1.COc1ccc2c(c1)C(=O)CC(C)(C)S2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 4/20 0.40
KLK7 P49862 1/20 0.40
CHRM1 P11229 4/20 0.39
DRD2 P14416 4/20 0.39
DRD4 P21917 4/20 0.39
DRD3 P35462 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
HTT P42858 2/20 0.38
LMNA P02545 1/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
RYR2 Q92736 1/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
PRNP P04156 1/20 0.35
HSD11B1 P28845 1/20 0.34
METAP1 P53582 1/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 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
SCHEMBL1140782 0.96 CHRM1 (0.41) KDM4EALDH1A1KLK7CHRM1DRD2
SCHEMBL1140756 0.86 ALDH1A1 (0.47) KDM4EALDH1A1KLK7SMN1; SMN2HTT
SCHEMBL4952807 0.82 CHRM1 (0.39) CHRM1DRD2DRD4DRD3
SCHEMBL6593100 0.77 KDM4E (0.34) KDM4EALDH1A1KLK7
SCHEMBL31260278 0.75 ALDH1A1 (0.57) KDM4EALDH1A1KLK7SMN1; SMN2HTT
SCHEMBL1987343 0.75 ALDH1A1 (0.57) KDM4EALDH1A1KLK7SMN1; SMN2HTT
SCHEMBL31260280 0.75 ALDH1A1 (0.57) KDM4EALDH1A1KLK7SMN1; SMN2HTT
SCHEMBL8771675 0.75 DRD2 (0.39) KDM4EALDH1A1KLK7CHRM1DRD2
SCHEMBL6086566 0.72 VHL (0.50) KDM4EALDH1A1CHRM1DRD2DRD4
SCHEMBL1091438 0.72 PGR (0.45) KDM4EALDH1A1CHRM1DRD2DRD4

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4738738-B2 2011-08-03 JP claimed
EP-1576089-A4 EXPANSION OF RENEWABLE STEM CELL POPULATIONS GAMIDA CELL LTD (IL) 2007-02-14 EP claimed
EP-1485464-A4 METHODS OF INDUCING DIFFERENTIATION IN EX VIVO EXPANDED STEM CELLS GAMIDA CELL LTD (IL) 2006-11-29 EP claimed
JP-2005528088-A 2005-09-22 JP claimed
EP-1576089-A2 EXPANSION OF RENEWABLE STEM CELL POPULATIONS Gamida Cell Ltd. (IL) 2005-09-21 EP claimed
EP-1534820-A2 EX-VIVO EXPANSION OF HEMATOPOIETIC STEM CELL POPULATIONS IN MONONUCLEAR CELL CULTURES Gamida Cell Ltd. (IL) 2005-06-01 EP claimed
US-20050008624-A1 Expansion of renewable stem cell populations GAMIDA CELL LTD. 2005-01-13 US claimed
EP-1485464-A2 METHODS OF INDUCING DIFFERENTIATION IN EX VIVO EXPANDED STEM CELLS Gamida Cell Ltd. (IL) 2004-12-15 EP claimed
WO-2004016731-A2 EX-VIVO EXPANSION OF HEMATOPOIETIC STEM CELL POPULATIONS IN MONONUCLEAR CELL CULTURES GAMIDA-CELL LTD. (IL) 2004-02-26 WO claimed
WO-2003078567-A2 METHODS OF INDUCING DIFFERENTIATION IN EX VIVO EXPANDED STEM CELLS GAMIDA-CELL LTD. (IL) 2003-09-25 WO claimed
WO-2003062369-A2 EXPANSION OF RENEWABLE STEM CELL POPULATIONS GAMIDA-CELL LTD. (IL) 2003-07-31 WO claimed
US-20180320139-A1 EXPANSION OF RENEWABLE STEM CELL POPULATIONS GAMIDA CELL INC. 2018-11-08 US disclosed
EP-2206773-B1 Expansion of renewable stem cell populations GAMIDA CELL LTD (IL) 2012-07-11 EP disclosed
US-7955852-B2 Expansion of renewable stem cell populations GAMIDA CELL LTD. (IL) 2011-06-07 US disclosed
EP-2305794-A1 Expansion of renewable stem cell populations Gamida Cell Ltd. (IL) 2011-04-06 EP disclosed
US-20050054097-A1 EX-VIVO expansion of hematopoietic system cell populations in mononuclear cell cultures GAMIDA CELL LTD. (IL) 2005-03-10 US disclosed
US-20050008624-A1 Expansion of renewable stem cell populations GAMIDA CELL LTD. 2005-01-13 US disclosed
EP-1485464-A2 METHODS OF INDUCING DIFFERENTIATION IN EX VIVO EXPANDED STEM CELLS Gamida Cell Ltd. (IL) 2004-12-15 EP disclosed
WO-2004016731-A2 EX-VIVO EXPANSION OF HEMATOPOIETIC STEM CELL POPULATIONS IN MONONUCLEAR CELL CULTURES GAMIDA-CELL LTD. (IL) 2004-02-26 WO disclosed
WO-2003078567-A2 METHODS OF INDUCING DIFFERENTIATION IN EX VIVO EXPANDED STEM CELLS GAMIDA-CELL LTD. (IL) 2003-09-25 WO disclosed