SCHEMBL8424948

SCHEMBL8424948

CC(O)C(CO)OCCN

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL13497198 0.81 TDP1 (0.36) TDP1
SCHEMBL11208111 0.81 TDP1 (0.36) TDP1
SCHEMBL16590506 0.79
SCHEMBL14895459 0.79 HSD17B10 (0.39) TDP1
SCHEMBL9562540 0.77 TDP1 (0.33) TDP1
SCHEMBL29144523 0.76 MGAM (0.39) TDP1
SCHEMBL28724981 0.74 ALDH1A1 (0.41) TDP1
SCHEMBL15808492 0.73
SCHEMBL393288 0.73
SCHEMBL28776415 0.73

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-0946549-A1 COMBINATORIAL PROCESS FOR PREPARING FUSED PYRIMIDINE LIBRARIES ELI LILLY AND COMPANY (US) 1999-10-06 EP disclosed
WO-1998027087-A1 COMBINATORIAL PROCESS FOR PREPARING FUSED PYRIMIDINE LIBRARIES ELI LILLY AND COMPANY (US) 1998-06-25 WO disclosed