SCHEMBL7900122

SCHEMBL7900122

[CH2]COC(=O)CC(=O)CC#N

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 4/20 0.35
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 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
SCHEMBL1417151 0.82
SCHEMBL5353289 0.79 GAA (0.56) MCL1MGAMGAASIMGAM2
SCHEMBL5353921 0.76 MCL1 (0.44) MCL1MGAMGAASIMGAM2
SCHEMBL11781367 0.73 FAAH (0.53) MCL1GAA
SCHEMBL5364350 0.71 ALDH1A1 (0.43) MCL1GAA
SCHEMBL6671142 0.71 FAAH (0.63)
SCHEMBL28508164 0.69 MCL1 (0.39) MCL1
SCHEMBL7827577 0.69
SCHEMBL3992204 0.68
SCHEMBL6670306 0.67

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-6197907-B1 LOW MOLECULAR WEIGHT HAVING A VERY LITTLE ODOR IS PRODUCED BY EMULSION-POLYMERIZING A RADICAL-POLYMERIZABLE UNSATURATED MONOMER AT A TEMPERATURE OF 115 DEGREES C. OR HIGHER IN THE PRESENCE OR ABSENCE OF A CHAIN TRANSFER AGENT. NIPPON CARBIDE KOGYO KABUSHIKI KAISHA (JP) 2001-03-06 US disclosed
EP-0931795-A1 POLYMER OBTAINED BY EMULSION POLYMERIZATION METHOD NIPPON CARBIDE KOGYO KABUSHIKI KAISHA (JP) 1999-07-28 EP disclosed