SCHEMBL10936358

SCHEMBL10936358

CCC(C(=O)NP(N)(N)=O)[N+](=O)[O-]

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL10934520 0.84
SCHEMBL10935382 0.84 ALDH1A1 (0.36) ALDH1A1
SCHEMBL10935388 0.81 ALDH1A1 (0.31) ALDH1A1
SCHEMBL29282734 0.76 ALDH1A1 (0.38) ALDH1A1USP2TSHR
SCHEMBL530226 0.71
SCHEMBL10934534 0.70 ALDH1A1 (0.31) ALDH1A1
SCHEMBL10937784 0.70 S1PR2 (0.37)
SCHEMBL10934008 0.69
SCHEMBL11627708 0.69
SCHEMBL11508090 0.69

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-4517003-A N-acyl phosphoric triamide urease inhibitors and urease inhibited urea based fertilizer compositions ALLIED CORPORATION (US) 1985-05-14 US disclosed