SCHEMBL9652156

SCHEMBL9652156

Cc1cn([C@H]2C[C@@](O)(F)[C@@H](C(O)S(C)(=O)=O)O2)c(=O)[nH]c1=O

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.43
DHFR P00374 1/20 0.41

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
SCHEMBL7255448 0.89 TK1 (0.43) TK1DHFR
SCHEMBL8401074 0.78 ALDH1A1 (0.40) TK1DHFR
SCHEMBL2056628 0.77 LMNA (0.51) TK1
SCHEMBL9011728 0.76 TK1 (0.50) TK1DHFR
SCHEMBL9011727 0.76 TK1 (0.50) TK1DHFR
SCHEMBL8510407 0.75 TK1 (0.60) TK1DHFR
SCHEMBL8771286 0.75 RNASE1 (0.45) TK1
Phosphoric Acid SCHEMBL1445017 0.73 TK1 (0.53) TK1
SCHEMBL8591789 0.73 TK1 (0.44) TK1DHFR
SCHEMBL1827367 0.73 TK1 (0.44) TK1DHFR

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-0495225-A1 Process for the preparation of 3'fluoropyrimidine nucleosides AMERICAN CYANAMID COMPANY (US) 1992-07-22 EP claimed
EP-0495225-A1 Process for the preparation of 3'fluoropyrimidine nucleosides AMERICAN CYANAMID COMPANY (US) 1992-07-22 EP disclosed