SCHEMBL7220527

SCHEMBL7220527

[CH2]CCN1CCCC(C(N)=O)C1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 0.63
GAA P10253 1/20 0.52
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.44
MAPK1 P28482 1/20 0.44
LMNA P02545 1/20 0.43
KDM2B Q8NHM5 3/20 0.42
LTA4H P09960 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL3518696 0.84 BCHE (0.65) BCHEGAAKMT2AMEN1ALDH1A1
SCHEMBL12011335 0.84 BCHE (0.65) BCHEGAAKMT2AMEN1ALDH1A1
SCHEMBL14524626 0.84 BCHE (0.65) BCHEGAAKMT2AMEN1ALDH1A1
SCHEMBL30587413 0.83 BCHE (0.72) BCHEGAAKMT2AMEN1ALDH1A1
SCHEMBL12155343 0.83 BCHE (0.77) BCHEGAAKMT2AALDH1A1MAPK1
SCHEMBL30587417 0.83 BCHE (0.72) BCHEGAAKMT2AMEN1ALDH1A1
SCHEMBL5047341 0.81 BCHE (0.70) BCHEGAAKMT2AMEN1ALDH1A1
SCHEMBL29833362 0.80 BCHE (0.59) BCHEGAAKMT2AMEN1ALDH1A1
SCHEMBL2560038 0.80 BCHE (0.60) BCHEGAAKMT2AMEN1ALDH1A1
SCHEMBL5242683 0.80 BCHE (0.60) BCHEGAAKMT2AMEN1ALDH1A1

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
US-6630485-B2 For therapy of inflammatory disease SYNTEX (U.S.A.) LLC 2003-10-07 US disclosed
US-6479507-B2 MODULATION OF THESE INFLAMMATORY CYTOKINES IS CONSIDERED ONE OF THE MOST EFFECTIVE STRATEGIES TO BLOCK CHRONIC INFLAMMATION AND HAVE POSITIVE THERAPEUTIC OUTCOMES SYNTEX (U.S.A.) LLC 2002-11-12 US disclosed
US-6316464-B1 P38 MAP kinase inhibitors SYNTEX (U.S.A.) LLC 2001-11-13 US disclosed
CN-1279682-A bicyclic kinase inhibitors HOFFMANN LA ROCHE (CH) 2001-01-10 CN disclosed