SCHEMBL2933749

SCHEMBL2933749

C#CCCCCC[CH]C#CCCCCCC

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 6/20 0.43
PTPN7 P35236 4/20 0.35
TSHR P16473 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
RECQL P46063 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL19640288 1.00 HMGCR (0.43) HMGCRPTPN7TSHRKDM4EALDH1A1
SCHEMBL3030008 0.90 HMGCR (0.49) HMGCRPTPN7TSHRRECQLTDP1
SCHEMBL10540472 0.90 HMGCR (0.49) HMGCRPTPN7TSHRRECQLTDP1
SCHEMBL28437823 0.90 HMGCR (0.49) HMGCRPTPN7TSHRRECQLTDP1
SCHEMBL1533719 0.84 HMGCR (0.42) HMGCRPTPN7TSHRKDM4EALDH1A1
SCHEMBL4763127 0.82 HMGCR (0.33) HMGCRTSHR
SCHEMBL6852096 0.82
SCHEMBL11180416 0.81 HMGCR (0.43) HMGCRPTPN7TSHRRECQLTDP1
SCHEMBL8157636 0.81 HMGCR (0.41) HMGCRPTPN7RECQLTDP1
SCHEMBL8385155 0.80 HMGCR (0.44) HMGCRPTPN7TSHRKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2229399-A1 INHIBITORS OF ANTIGEN PRESENTATION BY MHC CLASS II MOLECULES AND METHODS OF USE THEREOF Provid Pharmaceuticals, Inc. (US) 2010-09-22 EP disclosed
WO-2009073168-A1 INHIBITORS OF ANTIGEN PRESENTATION BY MHC CLASS II MOLECULES AND METHODS OF USE THEREOF PROVID PHARMACEUTICALS, INC. (US) 2009-06-11 WO disclosed
EP-1974013-A2 IMPROVED COMPOSITION FOR COLLECTING AND PRESERVING PLACENTAL STEM CELLS AND METHODS OF USING THE COMPOSITION Anthrogenesis Corporation (US) 2008-10-01 EP disclosed
WO-2007079185-A2 IMPROVED COMPOSITION FOR COLLECTING AND PRESERVING PLACENTAL STEM CELLS AND METHODS OF USING THE COMPOSITION ANTHROGENESIS CORPORATION (US) 2007-07-12 WO disclosed