SCHEMBL5994623

SCHEMBL5994623

NC(=O)NN1CCNC1.O=C(O)CNCO

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 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
SCHEMBL34371 0.83
SCHEMBL27888790 0.82 GNAI3 (0.34) GNAI3GNAO1GNAI1CA1CA2
SCHEMBL28189279 0.82 GNAI3 (0.34) GNAI3GNAO1GNAI1CA1CA2
Ammonia Solution, Strong SCHEMBL28242181 0.82 GNAI3 (0.34) GNAI3GNAO1GNAI1CA1CA2
Urea SCHEMBL6942842 0.82 GNAI3 (0.34) GNAI3GNAO1GNAI1CA1CA2
SCHEMBL7527875 0.82 GNAI3 (0.34) GNAI3GNAO1GNAI1CA1CA2
Nitrogen SCHEMBL20898038 0.80 GNAI3 (0.33) GNAI3GNAO1GNAI1
Trolamine SCHEMBL9054341 0.80 GNAI3 (0.31) GNAI3GNAO1GNAI1
Glycerin SCHEMBL9450682 0.78 GNAI3 (0.32) GNAI3GNAO1GNAI1
Glutamic Acid SCHEMBL10423280 0.77 GRM8 (0.49)

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-7005013-B2 Surfactant-free cleaning compositions and processes for the use thereof CLEAN CONTROL CORPORATION (US) 2006-02-28 US claimed