SCHEMBL11517907

SCHEMBL11517907

C=C(C)C(=O)N(CO)C(=O)CC

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
THRB P10828 1/20 0.31

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
SCHEMBL11519950 0.79 CHRM2 (0.33) TDP1
SCHEMBL7643150 0.72 ALDH1A1 (0.35) ALDH1A1
SCHEMBL19526538 0.71 CHRM2 (0.33) ALDH1A1TDP1
SCHEMBL8413747 0.70 CHRM1 (0.40) ALDH1A1TDP1THRB
SCHEMBL10783976 0.70 TDP1 (0.36) TDP1
SCHEMBL24315414 0.70 TDP1 (0.36) ALDH1A1TDP1THRB
SCHEMBL2184776 0.70 MAPT (0.33) TDP1
SCHEMBL263104 0.69 TDP1 (0.36) ALDH1A1TDP1
SCHEMBL11417281 0.69 TDP1 (0.36) ALDH1A1TDP1
SCHEMBL1901431 0.68 LMNA (0.36) TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4145500-A Stabilization of crosslinkable polymers BAYER AKTIENGESELLSCHAFT (DE) 1979-03-20 US disclosed