SCHEMBL7515264

SCHEMBL7515264

C=COC(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.54
BCL9 O00512 1/20 0.51
CTNNB1 P35222 1/20 0.51
KMT2A Q03164 3/20 0.50
PKM P14618 1/20 0.50
HTR2A P28223 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 2/20 0.47
TGM2 P21980 1/20 0.46
CES1 P23141 2/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CES2 O00748 1/20 0.46
MAPT P10636 2/20 0.46
MGLL Q99685 1/20 0.46
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
MAPK1 P28482 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL26374 0.85 GAA (0.65) GAABCL9CTNNB1KMT2APKM
SCHEMBL16583199 0.85 KMT2A (0.42) GAAKMT2APKMSMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL7895043 0.83 GAA (0.62) GAABCL9CTNNB1KMT2APKM
SCHEMBL17059152 0.83 GAA (0.54) GAABCL9CTNNB1KMT2APKM
SCHEMBL1421470 0.83 GAA (0.58) GAABCL9CTNNB1KMT2APKM
SCHEMBL15546810 0.82 GAA (0.57) GAABCL9CTNNB1KMT2APKM
SCHEMBL226894 0.82 GAA (0.57) GAABCL9CTNNB1KMT2APKM
SCHEMBL14378853 0.82 GAA (0.61) GAABCL9CTNNB1KMT2APKM
SCHEMBL3176066 0.82 GAA (0.61) GAABCL9CTNNB1KMT2APKM
SCHEMBL30086 0.81 HTR2A (0.56) GAABCL9CTNNB1KMT2APKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020151740-A1 Synthesis of vinyl carbonates for use in producing vinyl carbamates ALLEN DAVID LEWIS (US) 2002-10-17 US disclosed
US-6423862-B1 REACTING HALOFORMIC ACID DERIVATIVE WITH ALKALI METAL FLUORIDE IN PRESENCE OF PHASE TRANSFER CATALYST; REACTING PRODUCT WITH VINYL SILOXANE COMPOUND TO FORM VINYL CARBONATE DERIVATIVE WRIGHT CHEMICAL CORPORATION 2002-07-23 US disclosed
US-20020058829-A1 SYNTHESIS OF VINYL CARBONATES FOR USE IN PRODUCING VINYL CARBAMATES ALLEN DAVID LEWIS (US) 2002-05-16 US disclosed
US-6362363-B1 REACTING HALOFORMIC ACID, ALKALI METAL FLUORIDE, A VINYLOXYSILANE, AND AN AMINE; PHASE TRANSFER AGENTS WRIGHT CHEMICAL CORPORATION 2002-03-26 US disclosed
US-6284911-B1 FLUORINATING A HALOFORMATE WITH A IA METAL FLUORIDE IN THE PRESENCE OF A PHASE TRANSFER CATALYST AND A SOLVENT; ESTERIFIFYING PRODUCT WITH A TRIHYDROCARBYL(VINYLOXY)SILANE WRIGHT CHEMICAL CORPORATION 2001-09-04 US disclosed
WO-2001000634-A1 SYNTHESIS OF VINYL CARBONATES FOR USE IN PRODUCING VINYL CARBAMATES WRIGHT CHEMICAL CORPORATION (US) 2001-01-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020058829-A1 SYNTHESIS OF VINYL CARBONATES FOR USE IN PRODUCING VINYL CARBAMATES F12, F11, ME1 GAA 3811/4885BCL9 1658/4885CTNNB1 3421/4885
US-20020151740-A1 Synthesis of vinyl carbonates for use in producing vinyl carbamates F12, F11, ME1 GAA 3811/4885BCL9 1658/4885CTNNB1 3421/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.