SCHEMBL27913402

SCHEMBL27913402

NC(=O)NOONC(N)=O.[Ti].[Ti]

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
TSHR P16473 2/20 0.44
NFKB1 P19838 2/20 0.44
BLM P54132 2/20 0.44
PMP22 Q01453 2/20 0.44
CYP1A2 P05177 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
THPO P40225 1/20 0.44
CA2 P00918 1/20 0.44
CYP3A4 P08684 1/20 0.44
CA5A P35218 1/20 0.44
CA9 Q16790 1/20 0.44
ALDH1A1 P00352 1/20 0.36
OR51E2 Q9H255 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CRBN Q96SW2 1/20 0.35
ACHE P22303 1/20 0.33
ALOX15 P16050 1/20 0.31

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
SCHEMBL33749 0.96 LMNA (0.47) LMNATSHRNFKB1BLMPMP22
Hydrochloric Acid SCHEMBL28091299 0.92 LMNA (0.50) LMNATSHRNFKB1BLMPMP22
Water SCHEMBL6817829 0.92 LMNA (0.44) LMNATSHRNFKB1BLMPMP22
SCHEMBL3773719 0.92 LMNA (0.44) LMNATSHRNFKB1BLMPMP22
SCHEMBL28009309 0.81 LMNA (0.41) LMNATSHRNFKB1BLMPMP22
SCHEMBL27709209 0.79
SCHEMBL27861390 0.74
SCHEMBL8761075 0.74
SCHEMBL5409424 0.72
SCHEMBL21801991 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103011974-A Manufacture method of chitin biological fertilizer with slow-release function FUJIAN CHAODA GROUP CO LTD 2013-04-03 CN disclosed
CN-103011973-A Manufacture method of synergic type nitrogen-phosphorus-potassium mixed fertilizer with slow release and loss control effect FUJIAN CHAODA GROUP CO LTD 2013-04-03 CN disclosed
CN-103011971-A Manufacturing method of compound organic fertilizer with fertilizer-retaining and loss-controlling functions FUJIAN CHAODA GROUP CO LTD 2013-04-03 CN disclosed
CN-103011972-A Manufacture method of synergic type nitrogenous fertilizer with slow release and loss control effect FUJIAN CHAODA GROUP CO LTD 2013-04-03 CN disclosed
CN-103011970-A Manufacturing method of multifunctional humic acid fertilizer with water retention and fertilizer retention functions FUJIAN CHAODA GROUP CO LTD 2013-04-03 CN disclosed