SCHEMBL6851630

SCHEMBL6851630

COC(=O)C(I)CCC(I)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
MME P08473 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
SLC1A1 P43005 1/20 0.35
FOLH1 Q04609 1/20 0.35
ZDHHC7 Q9NXF8 1/20 0.34
GABRR1 P24046 2/20 0.33
KMT2A Q03164 2/20 0.33
TGFBR1 P36897 1/20 0.31
CPA1 P15085 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
DRD3 P35462 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
SCHEMBL2859567 0.91 SMN1; SMN2 (0.42) CA1CA2MMESMN1; SMN2SLC1A1
SCHEMBL6760312 0.81 CA1 (0.43) CA1CA2SMN1; SMN2FOLH1ZDHHC7
SCHEMBL2865718 0.81 ZDHHC7 (0.45) CA1CA2SMN1; SMN2ZDHHC7KMT2A
SCHEMBL2856423 0.80 SMN1; SMN2 (0.42) CA1CA2MMESMN1; SMN2ZDHHC7
SCHEMBL7247500 0.80 GABRR1 (0.39) SLC1A1GABRR1CHRM1AKR1A1CHRM3
SCHEMBL3134446 0.80 GABRR1 (0.39) SLC1A1GABRR1CHRM1AKR1A1CHRM3
SCHEMBL7068071 0.79
SCHEMBL2592840 0.79
SCHEMBL7970973 0.77 CA1 (0.41) CA1CA2SMN1; SMN2ZDHHC7CA14
SCHEMBL3813450 0.76 CA2 (0.59) CA1CA2ZDHHC7TDP1

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
US-6784256-B1 CONTROLLED FREE- RADICAL POLYMERIZATION PROCESS FOR FORMING END-FUNCTIONALIZED POLYMERS, PARTICULARLY BY A DEGENERATIVE IODINE TRANSFER AND ATOM TRANSFER RADICAL POLYMERIZATION PROCESSES NOVEON IP HOLDINGS CORP. 2004-08-31 US claimed
WO-1999020659-A1 END-FUNCTIONALIZED POLYMERS BY CONTROLLED FREE-RADICAL POLYMERIZATION PROCESS AND POLYMERS MADE THEREFROM THE B.F. GOODRICH COMPANY (US) 1999-04-29 WO claimed