SCHEMBL9011728

SCHEMBL9011728

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

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TK1 P04183 5/20 0.50
DHFR P00374 1/20 0.47

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
SCHEMBL9011727 1.00 TK1 (0.50) TK1DHFR
SCHEMBL8510407 0.88 TK1 (0.60) TK1DHFR
SCHEMBL9011672 0.83 TK1 (0.51) TK1DHFR
SCHEMBL9011668 0.83 TK1 (0.51) TK1DHFR
SCHEMBL4810922 0.83 TK1 (0.53) TK1DHFR
SCHEMBL6379327 0.77 TK1 (0.67) TK1DHFR
SCHEMBL7172771 0.77 TK1 (0.56) TK1DHFR
SCHEMBL2295 0.77 TK1 (0.63) TK1DHFR
SCHEMBL9652156 0.76 TK1 (0.43) TK1DHFR
SCHEMBL24559528 0.75 TK1 (0.55) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0472019-B1 Process for producing 3'-deoxy-3'-fluorothymidine YUKI GOSEI YAKUHIN KOGYO KK (JP) 1996-11-20 EP claimed
US-5166327-A PROCESS FOR PRODUCING 3'-DEOXY-3-'-FLUOROTHYMIDINE YUKI GOSEI KOGYO CO., LTD. (JP) 1992-11-24 US claimed
EP-0472019-A1 Process for producing 3'-deoxy-3'-fluorothymidine YUKI GOSEI KOGYO CO., LTD. (JP) 1992-02-26 EP claimed
JP-4217692-A None JP disclosed
EP-0472019-B1 Process for producing 3'-deoxy-3'-fluorothymidine YUKI GOSEI YAKUHIN KOGYO KK (JP) 1996-11-20 EP disclosed
US-5538961-A IMPROVING MOTILITY IN GASTROINTESTINAL TRACT ABBOTT LABORATORIES (US) 1996-07-23 US disclosed
US-5166327-A PROCESS FOR PRODUCING 3'-DEOXY-3-'-FLUOROTHYMIDINE YUKI GOSEI KOGYO CO., LTD. (JP) 1992-11-24 US disclosed
JP-H04217692-A PRODUCTION OF 3'-DEOXY-3'-FLUOROTHYMIDINE YUKI GOSEI KOGYO CO LTD 1992-08-07 JP disclosed
EP-0472019-A1 Process for producing 3'-deoxy-3'-fluorothymidine YUKI GOSEI KOGYO CO., LTD. (JP) 1992-02-26 EP disclosed
EP-0472019-A1 Process for producing 3'-deoxy-3'-fluorothymidine YUKI GOSEI KOGYO CO., LTD. (JP) 1992-02-26 EP disclosed