SCHEMBL11037652

SCHEMBL11037652

CCCCC(CCCC)(CC(CCCC)(CCCC)N=C=O)N=C=O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.30

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
SCHEMBL11044227 0.93 FDPS (0.33) FDPS
SCHEMBL11038261 0.91 GGPS1 (0.36) FDPS
SCHEMBL11046871 0.86
SCHEMBL11040522 0.82 GGPS1 (0.39) FDPS
SCHEMBL25169840 0.78 GGPS1 (0.36) FDPS
SCHEMBL8763217 0.78 GGPS1 (0.36) FDPS
SCHEMBL2017646 0.78 NAAA (0.35)
SCHEMBL10987824 0.77 NAAA (0.38)
SCHEMBL5478038 0.76 FDPS (0.32) FDPS
SCHEMBL11407031 0.75

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-0025907-B1 HALOGENATED TERTIARY ALKYL ISOCYANATES AND PROCESS FOR THEIR PREPARATION BASF Aktiengesellschaft (DE) 1984-06-20 EP disclosed
US-4344891-A Halogenated tertiary alkyl isocyanates and their preparation BASF AKTIENGESELLSCHAFT (DE) 1982-08-17 US disclosed
EP-0025907-A1 Halogenated tertiary alkyl isocyanates and process for their preparation BASF Aktiengesellschaft (DE) 1981-04-01 EP disclosed