SCHEMBL4817167

SCHEMBL4817167

CC(C)N1CN(C(C)C)CC(CO)([N+](=O)[O-])C1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.32
GAA P10253 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
SCHEMBL4443823 0.76 APEX1 (0.38) APEX1GAA
SCHEMBL4851929 0.70 APEX1 (0.44) APEX1GAA
Hydrochloric Acid SCHEMBL3737938 0.69 CRHBP (0.52)
Methylamine SCHEMBL11565513 0.68 ALDH1A1 (0.31)
SCHEMBL9346675 0.64 LMNA (0.35) GAA
SCHEMBL20695436 0.64 NR1H2 (0.41)
SCHEMBL4933544 0.63 ALDH1A1 (0.31)
SCHEMBL1117432 0.62 TSHR (0.30)
SCHEMBL28829489 0.62 TSHR (0.30)
SCHEMBL21626522 0.60 GAA (0.31) GAA

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
US-7319130-B2 Phenolic resins ANGUS CHEMICAL COMPANY (US) 2008-01-15 US disclosed
US-7319130-B2 Phenolic resins ANGUS CHEMICAL COMPANY (US) 2008-01-15 US disclosed
US-7319130-B2 Phenolic resins ANGUS CHEMICAL COMPANY (US) 2008-01-15 US disclosed
US-7317063-B2 Phenolic resins ANGUS CHEMICAL COMPANY (US) 2008-01-08 US disclosed
US-7317063-B2 Phenolic resins ANGUS CHEMICAL COMPANY (US) 2008-01-08 US disclosed
US-7317063-B2 Phenolic resins ANGUS CHEMICAL COMPANY (US) 2008-01-08 US disclosed
US-20070055041-A1 Novel phenolic resins SWEDO RAYMOND J 2007-03-08 US disclosed
US-20070055041-A1 Novel phenolic resins SWEDO RAYMOND J 2007-03-08 US disclosed
US-20070055041-A1 Novel phenolic resins SWEDO RAYMOND J 2007-03-08 US disclosed
EP-1569975-A2 PHENOLIC RESINS ANGUS CHEMICAL COMPANY (US) 2005-09-07 EP disclosed
US-20040198926-A1 Novel phenolic resins ANGUS CHEMICAL COMPANY 2004-10-07 US disclosed
US-20040116647-A1 Novel phenolic resins ANGUS CHEMICAL COMPANY 2004-06-17 US disclosed
WO-2004050733-A2 PHENOLIC RESINS ANGUS CHEMICAL COMPANY (US) 2004-06-17 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 (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-20040198926-A1 Novel phenolic resins PNMT, NNMT, PNN APEX1 142/4885GAA 2303/4885

“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.