SCHEMBL6041022

SCHEMBL6041022

NP(N)(=S)N1CCSCC1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.32
PHGDH O43175 1/20 0.32
MGLL Q99685 1/20 0.32
ABCB11 O95342 1/20 0.32
LMNA P02545 1/20 0.32
CHRM2 P08172 1/20 0.32
CYP3A4 P08684 1/20 0.32
ADRA2A P08913 1/20 0.32
CHRM1 P11229 1/20 0.32
DRD2 P14416 1/20 0.32
HPGD P15428 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
CHRM3 P20309 1/20 0.32
CYP2B6 P20813 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
SLC6A4 P31645 1/20 0.32
ADRA1A P35348 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
SCHEMBL10931717 0.78 ABCB11 (0.50) ABCB11LMNACHRM2CYP3A4ADRA2A
SCHEMBL6041009 0.78
SCHEMBL6040985 0.73
SCHEMBL745787 0.73
SCHEMBL6041036 0.71 LMNA (0.35) ABCB11LMNACHRM2CYP3A4ADRA2A
SCHEMBL6048121 0.69 ABCB11 (0.33) ABCB11LMNACHRM2CYP3A4ADRA2A
SCHEMBL28546792 0.69 FDPS (0.46) FAAHPHGDHMGLLFDPS
SCHEMBL1843941 0.59
SCHEMBL971418 0.59
SCHEMBL433171 0.59

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015020967-A1 NBPT SOLUTIONS FOR PREPARING UREASE INHIBITED UREA FERTILIZERS PREPARED FROM N-SUBSTITUTED MORPHOLINES WEYERHAEUSER NR COMPANY (US) 2015-02-12 WO disclosed
US-8888886-B1 NBPT solutions for preparing urease inhibited urea fertilizers prepared from N-substituted morpholines WHITEHURST ASSOCIATES, INC. 2014-11-18 US disclosed
EP-1632253-A1 Material for odour control BKI Holding Corporation (US) 2006-03-08 EP disclosed
WO-2006017441-A1 MATERIAL FOR ODOR CONTROL BKI HOLDING CORPORATION (US) 2006-02-16 WO disclosed
US-20060029567-A1 Material for odor control BKI HOLDING CORPORATION (US) 2006-02-09 US disclosed
EP-0119487-B1 NOVEL N-ALIPHATIC AND N,N-ALIPHATIC PHOSPHORIC TRIAMIDE UREASE INHIBITORS AND UREASE INHIBITED UREA BASED FERTILIZER COMPOSITIONS ALLIED CORPORATION (US) 1986-07-16 EP disclosed
US-4530714-A Capable of forming urea under use conditions ALLIED CORPORATION (US) 1985-07-23 US disclosed
EP-0119487-A1 Novel N-aliphatic and N,N-aliphatic phosphoric triamide urease inhibitors and urease inhibited urea based fertilizer compositions ALLIED CORPORATION (US) 1984-09-26 EP disclosed