SCHEMBL3780129

SCHEMBL3780129

CCOP(=O)(CC)OCN

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.75
PPARD Q03181 2/20 0.44
TP53 P04637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ACHE P22303 1/20 0.35
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP3A4 P08684 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
Oxalic Acid SCHEMBL3483591 0.89 TSHR (0.60) TSHRPPARDTP53TDP1ACHE
SCHEMBL26483 0.87 TSHR (1.00) TSHRPPARDTP53TDP1ACHE
SCHEMBL5961215 0.87 TSHR (1.00) TSHRPPARDTP53TDP1ACHE
SCHEMBL28492909 0.84 TSHR (0.94) TSHRPPARDTP53TDP1ACHE
SCHEMBL31574613 0.84 TSHR (0.94) TSHRPPARDTP53TDP1ACHE
SCHEMBL11745101 0.84 TSHR (0.94) TSHRPPARDTP53TDP1ACHE
SCHEMBL29034374 0.84 TSHR (0.94) TSHRPPARDTP53TDP1ACHE
Ammonia Solution, Strong SCHEMBL27738152 0.84 TSHR (0.94) TSHRPPARDTP53TDP1ACHE
SCHEMBL6802770 0.80 TSHR (0.75) TSHRPPARDTP53TDP1ACHE
Butylamine SCHEMBL28428506 0.79 TSHR (0.65) TSHRPPARDMEN1KMT2ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108570072-B Method for synthesizing phosphonic acid modified graphene or phosphonate modified graphene 新乡学院 2020-02-07 CN claimed
CN-108570072-B Method for synthesizing phosphonic acid modified graphene or phosphonate modified graphene 新乡学院 2020-02-07 CN disclosed
US-8486203-B2 Conversion coating and anodizing sealer with no chromium METALAST INTERNATIONAL, INC. (US) 2013-07-16 US disclosed
US-20100314004-A1 CONVERSION COATING AND ANODIZING SEALER WITH NO CHROMIUM CHEMEON SURFACE TECHNOLOGY, LLC 2010-12-16 US disclosed
EP-1378585-B1 Corrosion resistant trivalent chromium phosphated chemical conversion coatings UNITED TECHNOLOGIES CORP (US) 2008-08-13 EP disclosed
US-7018486-B2 Corrosion resistant trivalent chromium phosphated chemical conversion coatings UNITED TECHNOLOGIES CORPORATION (US) 2006-03-28 US disclosed
US-20050178475-A9 Corrosion resistant trivalent chromium phosphated chemical conversion coatings RTX CORPORATION 2005-08-18 US disclosed
EP-1378585-A1 Corrosion resistant trivalent chromium phosphated chemical conversion coatings UNITED TECHNOLOGIES CORPORATION (US) 2004-01-07 EP disclosed
US-20040000358-A1 Corrosion resistant trivalent chromium phosphated chemical conversion coatings BHATIA PROMILA (US) 2004-01-01 US disclosed
US-5208224-A Phosphorus containing compounds as antihypercholesterolemic and antiatherosclerotic agents WARNER-LAMBERT COMPANY (US) 1993-05-04 US disclosed
US-4493931-A REACTING PHOSPHORAMIDE WITH ALDEHYDE, THEN A BASE, HEATING, HYDROLYSIS, REDUCTION, AND ACID TREATMENT SANOFI (FR) 1985-01-15 US disclosed
US-4454073-A HERBICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-06-12 US disclosed
EP-0063411-A1 Substituted methanephoshonic acid derivatives, their use as herbicides, herbicidal compositions containing them, and processes for preparing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-10-27 EP disclosed