SCHEMBL5376086

SCHEMBL5376086

N#[N+]c1ccc(CO)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
VHL P40337 1/20 0.38
ELOC Q15369 1/20 0.38
ELOB Q15370 1/20 0.38
LTA4H P09960 1/20 0.38
CA12 O43570 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35

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
SCHEMBL7168345 0.91 TSHR (0.37) TSHRPRSS1PRSS2PRSS3CA1
SCHEMBL5370132 0.82 APP (0.46) PRSS1PRSS2PRSS3LTA4H
SCHEMBL2871430 0.80 CA2 (0.52) TSHRCA1CA2CA12CA4
SCHEMBL5369636 0.78 KMT2A (0.59) TSHRCA1CA2CA12CA4
SCHEMBL19416225 0.78 ALDH1A1 (0.44) TSHRCA1CA2LTA4HCA4
SCHEMBL5372798 0.77 EPHX2 (0.61) CA1CA2ALDH1A1SMN1; SMN2
SCHEMBL1304591 0.76
SCHEMBL41775 0.76 TSHR (0.67) TSHRPRSS1PRSS2PRSS3CA1
Fluoride Ion SCHEMBL1694379 0.76 ALDH1A1 (0.42) TSHRLTA4HALDH1A1TP53CYP2C9
Hydrochloric Acid SCHEMBL9445131 0.76 ALDH1A1 (0.42) TSHRLTA4HCYP11B1CYP11B2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7229668-B2 Process for the electrochemical production of a carbon-containing material whose surface is modified with organic groups, and use of the modified material CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2007-06-12 US claimed
CN-101426589-A By selective chemical modification carbon nanotube coating is formed pattern ELKOS INC (US) 2009-05-06 CN disclosed
US-7229668-B2 Process for the electrochemical production of a carbon-containing material whose surface is modified with organic groups, and use of the modified material CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2007-06-12 US disclosed
EP-1750859-A2 PATTERNING CARBON NANOTUBE COATINGS BY SELECTIVE CHEMICAL MODIFICATION Elkos, Inc. (US) 2007-02-14 EP disclosed
WO-2006078286-A2 PATTERNING CARBON NANOTUBE COATINGS BY SELECTIVE CHEMICAL MODIFICATION EIKOS, INC. (US) 2006-07-27 WO disclosed
US-20060057290-A1 Patterning carbon nanotube coatings by selective chemical modification EIKOS, INC. 2006-03-16 US disclosed
US-20020144912-A1 Process for the electrochemical production of a carbon-containing material whose surface is modified with organic groups, and use of the modified material CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) 2002-10-10 US disclosed
US-6435240-B1 Process for the electrochemical production of a carbon-containing material whose surface is modified with organic groups, and use of the modified material CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2002-08-20 US disclosed
EP-0970265-B1 METHOD FOR PRODUCING BY ELECTROCHEMICAL PROCESS A CARBON-CONTAINING MATERIAL WITH ITS SURFACE MODIFIED BY ORGANIC GROUPS, USE OF THE MODIFIED MATERIAL CENTRE NAT RECH SCIENT (FR) 2002-07-03 EP disclosed
EP-0970265-A1 METHOD FOR PRODUCING BY ELECTROCHEMICAL PROCESS A CARBON-CONTAINING MATERIAL WITH ITS SURFACE MODIFIED BY ORGANIC GROUPS, USE OF THE MODIFIED MATERIAL CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2000-01-12 EP disclosed
WO-1998044172-A1 METHOD FOR PRODUCING BY ELECTROCHEMICAL PROCESS A CARBON-CONTAINING MATERIAL WITH ITS SURFACE MODIFIED BY ORGANIC GROUPS, USE OF THE MODIFIED MATERIAL CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S) (FR) 1998-10-08 WO disclosed