SCHEMBL6078786

SCHEMBL6078786

NCC(=O)OC(=O)c1ccccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
L3MBTL1 Q9Y468 5/20 0.48
LMNA P02545 1/20 0.48
NAPRT Q6XQN6 1/20 0.48
P4HTM Q9NXG6 1/20 0.48
ALDH1A1 P00352 3/20 0.47
THRB P10828 1/20 0.46
KDM4E B2RXH2 2/20 0.46
GAA P10253 1/20 0.46
NPC1 O15118 2/20 0.45
PKM P14618 2/20 0.45
RAB9A P51151 2/20 0.45
MITF O75030 1/20 0.45
CDK5 Q00535 1/20 0.45
CDK5R1 Q15078 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
TP53 P04637 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL29120006 0.86 CES2 (0.53) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL14609300 0.84 ALDH1A1 (0.53) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL31633615 0.83 CES2 (0.64) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL1228223 0.83 CES2 (0.64) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL8153445 0.83 ALDH1A1 (0.47) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL9221780 0.80 CES2 (0.55) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL29120007 0.80 L3MBTL1 (0.50) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL9203015 0.80 ALDH1A1 (0.49) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL27757257 0.79 NPC1 (0.51) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL29554609 0.79 L3MBTL1 (0.55) CES2CES1L3MBTL1LMNANAPRT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101506149-A Prolyl hydroxylase inhibitors and methods of use PROCTER & GAMBLE (US) 2009-08-12 CN claimed
CN-101506149-A Prolyl hydroxylase inhibitors and methods of use PROCTER & GAMBLE (US) 2009-08-12 CN disclosed
US-7115612-B2 Arylsulfonamides as antiviral agents BAYER AKTIENGESELLSCHAFT (DE) 2006-10-03 US disclosed
US-20040176374-A1 Arylsulfonamides as antiviral agents AIC246 AG & CO. KG (DE) 2004-09-09 US 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 (1 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-20040176374-A1 Arylsulfonamides as antiviral agents IFNAR1, ARSA, TPMT CES2 223/4885CES1 149/4885L3MBTL1 2646/4885

“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.