SCHEMBL10692812

SCHEMBL10692812

CN(CCC(=N)N)C(=O)c1cc(N(C)C(=O)c2cc(NC(=O)C3CO3)c[nH]2)c[nH]1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.34

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
Hydrochloric Acid SCHEMBL10691653 0.99 DAO (0.34) DAO
SCHEMBL10690621 0.89 DAO (0.35) DAO
Hydrochloric Acid SCHEMBL10693182 0.88 DAO (0.35) DAO
SCHEMBL10688875 0.88 DAO (0.35) DAO
Hydrochloric Acid SCHEMBL10691112 0.87 DAO (0.34) DAO
SCHEMBL10693179 0.86 DAO (0.36) DAO
SCHEMBL10688638 0.86 DAO (0.36) DAO
SCHEMBL10691962 0.86 DAO (0.36) DAO
Hydrochloric Acid SCHEMBL10693082 0.85 DAO (0.35) DAO
Hydrochloric Acid SCHEMBL10692986 0.85 DAO (0.35) DAO

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4766142-A ANTICARCINOGENIC AGENTS FARMITALIA CARLO ERBA S.R.L. (IT) 1988-08-23 US disclosed