SCHEMBL7221864

SCHEMBL7221864

CC(=O)OC1C[C@@H](n2cc(C#CCNC(=O)C(F)(F)F)c(=O)[nH]c2=O)O[C@H]1CO

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RNASE1 P07998 1/20 0.48
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALOX12 P18054 1/20 0.44
ADRA1A P35348 1/20 0.44
SLC6A2 P23975 1/20 0.42

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
SCHEMBL1566423 1.00 RNASE1 (0.48) RNASE1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL15061820 0.89 RNASE1 (0.44) RNASE1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL14397161 0.89 RNASE1 (0.38) RNASE1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL2619370 0.89 RNASE1 (0.43) RNASE1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL20810838 0.89 RNASE1 (0.43) RNASE1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL20810870 0.89 RNASE1 (0.43) RNASE1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL2611630 0.88 RNASE1 (0.42) RNASE1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL2122164 0.88 RNASE1 (0.42) RNASE1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL2122161 0.88 RNASE1 (0.42) RNASE1LMNASMN1; SMN2ALOX12ADRA1A
SCHEMBL4729467 0.87 RNASE1 (0.42) RNASE1LMNASMN1; SMN2ALOX12ADRA1A

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-6627456-B1 Incorporating into the oligonucleotide analogs that are the components of a library to which in vitro selection methods functionalized standard and non-standard nucleotides, and incorporating functionalized cofactors into the experiment BENNER, STEVEN 2003-09-30 US disclosed
US-5965364-A Method for selecting functional deoxyribonucleotide derivatives BENNER, STEVEN 1999-10-12 US disclosed