SCHEMBL4851929

SCHEMBL4851929

CCCN1CN(CCC)CC(CO)([N+](=O)[O-])C1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.44
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.31
PKM P14618 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL27881243 0.83 ALDH1A1 (0.39) APEX1ALDH1A1PKMMAPT
SCHEMBL4443823 0.78 APEX1 (0.38) APEX1GAA
SCHEMBL4817167 0.70 APEX1 (0.32) APEX1GAA
SCHEMBL9346675 0.70 LMNA (0.35) GAALMNA
SCHEMBL2244583 0.69 CRHBP (0.53) APEX1
Hydrochloric Acid SCHEMBL3737938 0.68 CRHBP (0.52)
SCHEMBL7375958 0.68 MC4R (0.50) ALDH1A1LMNAMAPTL3MBTL1
Methylamine SCHEMBL11565513 0.66 ALDH1A1 (0.31) ALDH1A1
SCHEMBL4933544 0.62 ALDH1A1 (0.31) ALDH1A1
SCHEMBL24670563 0.62 KDM4E (0.37) L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7317064-B2 Phenolic resin systems for fiber reinforced composite manufacture ANGUS CHEMICAL COMPANY (US) 2008-01-08 US disclosed
US-20050009980-A1 Phenolic resin systems for fiber reinforced composite manufacture ANGUS CHEMICAL COMPANY 2005-01-13 US disclosed