SCHEMBL11683038

SCHEMBL11683038

CC(C)(N=NC(C)(C)C(=O)NCCO)C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.37
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 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
SCHEMBL17732616 0.90 CNR1 (0.41) CNR1ALDH1A1MAPTMEN1USP2
SCHEMBL35560 0.90 CNR1 (0.41) CNR1ALDH1A1MAPTMEN1USP2
SCHEMBL35559 0.90 CNR1 (0.41) CNR1ALDH1A1MAPTMEN1USP2
SCHEMBL11683415 0.89 PTGS1 (0.40) CNR1ALDH1A1MEN1KMT2A
Water SCHEMBL31205630 0.88 CNR1 (0.41) CNR1ALDH1A1MAPTMEN1USP2
Hydrochloric Acid SCHEMBL7063391 0.84 ALDH1A1 (0.53) CNR1ALDH1A1MAPTCYP3A4CYP2D6
SCHEMBL11683423 0.84
SCHEMBL17082484 0.84 CNR1 (0.36) CNR1ALDH1A1MAPTMEN1USP2
SCHEMBL11684711 0.84 FAAH (0.33) ALDH1A1MEN1KMT2A
SCHEMBL15745360 0.83 CNR1 (0.38) CNR1ALDH1A1MAPTMEN1USP2

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-20160177006-A1 ION EXCHANGE FILM, COMPOSITION FOR FORMING ION EXCHANGE FILM, AND PRODUCTION METHOD FOR ION EXCHANGE FILM FUJIFILM CORPORATION (JP) 2016-06-23 US disclosed
US-4059574-A POLYMERIZATION CATALYSTS ROHM GMBH (DT) 1977-11-22 US disclosed