Nitrous Acid

Nitrous Acid

SCHEMBL8991751

CCC(C)(C)N=NC(C)(C)CC.O=NO

nearest known ligand 0.35

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Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
TSHR P16473 2/20 0.32
TDP1 Q9NUW8 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
Nitrous Acid SCHEMBL8654980 1.00 CA1 (0.35) CA1CA2TSHRTDP1
SCHEMBL185754 0.84 TSHR (0.43) TSHRTDP1
SCHEMBL1253185 0.84 TSHR (0.43) TSHRTDP1
Nitrous Acid SCHEMBL7836253 0.78 FDPS (0.32) CA1CA2
SCHEMBL11679490 0.77 TSHR (0.32) TSHRTDP1
SCHEMBL11679488 0.77 TSHR (0.32) TSHRTDP1
SCHEMBL2939029 0.75 TSHR (0.35) TSHRTDP1
SCHEMBL2939027 0.75 TSHR (0.35) TSHRTDP1
SCHEMBL11678892 0.74 TSHR (0.30) TSHRTDP1
SCHEMBL11712894 0.74 TSHR (0.30) TSHRTDP1

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-5587431-A Synthesis of terminally unsaturated oligomers E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-12-24 US disclosed