SCHEMBL5583976

SCHEMBL5583976

CC(=O)C(O)[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@@H]1O

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TK1 P04183 5/20 0.61
DHFR P00374 1/20 0.49

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
SCHEMBL2056551 0.91 TK1 (0.61) TK1
SCHEMBL2056547 0.91 TK1 (0.61) TK1
SCHEMBL6379327 0.89 TK1 (0.67) TK1DHFR
SCHEMBL8999362 0.88 TK1 (0.57) TK1
SCHEMBL9011668 0.87 TK1 (0.51) TK1DHFR
SCHEMBL9011672 0.87 TK1 (0.51) TK1DHFR
SCHEMBL24420522 0.87 TK1 (0.65) TK1DHFR
SCHEMBL27054363 0.87 TK1 (0.65) TK1DHFR
SCHEMBL7537554 0.87 TK1 (0.65) TK1DHFR
SCHEMBL658884 0.87 TK1 (0.65) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1425417-B1 INTERACTION DETECTION ON SEVERAL PROBE ARRAYS CLONDIAG CHIP TECH GMBH (DE) 2007-10-31 EP disclosed
US-20050147984-A1 Interaction detection on several probe arrays CLONDIAG CHIP TECHNOLOGIES GMBH (DE) 2005-07-07 US disclosed
US-6348451-B1 WOUND HEALING AGENTS FOR ANIMALS PRO-NEURON, INC. 2002-02-19 US disclosed