SCHEMBL8736355

SCHEMBL8736355

CC(O)C(Br)(C(O)CC(O)C(Br)(Br)[N+](=O)[O-])[N+](=O)[O-]

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36

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
SCHEMBL2728735 0.78 LMNA (0.39) LMNA
SCHEMBL92188 0.74 LMNA (0.36) LMNA
SCHEMBL426138 0.74
SCHEMBL1703308 0.72 LMNA (0.39) LMNA
SCHEMBL8736354 0.70 LMNA (0.43) LMNA
SCHEMBL1703301 0.66 LMNA (0.36) LMNA
SCHEMBL11574944 0.66 LMNA (0.36) LMNA
SCHEMBL2550497 0.63
SCHEMBL1702973 0.63
SCHEMBL92233 0.63 LMNA (0.48) LMNA

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-0648415-B1 Clathrate compound including water-soluble microbicide KURITA WATER IND LTD (JP) 1998-12-02 EP disclosed
EP-0648415-A2 Clathrate compound including water-soluble microbicide KURITA WATER INDUSTRIES LTD. (JP) 1995-04-19 EP disclosed