SCHEMBL11243861

SCHEMBL11243861

CCOC(=O)C1(F)C(=O)NC(=O)NC1N1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 7/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
POLB P06746 3/20 0.36
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL11236134 0.76 ALDH1A1 (0.43) ALDH1A1HSD17B10MEN1KMT2APOLB
SCHEMBL11233822 0.76 ALDH1A1 (0.42) ALDH1A1HSD17B10MEN1KMT2APOLB
SCHEMBL11250408 0.73 ALDH1A1 (0.40) ALDH1A1HSD17B10MEN1KMT2APOLB
SCHEMBL11237613 0.73 POLB (0.35) ALDH1A1MEN1KMT2APOLBHTT
SCHEMBL11247825 0.73 ALDH1A1 (0.38) ALDH1A1HSD17B10MEN1KMT2APOLB
SCHEMBL11236245 0.72 ALDH1A1 (0.39) ALDH1A1HSD17B10MEN1KMT2APOLB
SCHEMBL11475056 0.71 POLB (0.33) ALDH1A1POLBHTTTDP1SMN1; SMN2
SCHEMBL11241152 0.71 ALDH1A1 (0.38) MAPK1ALDH1A1HSD17B10MEN1KMT2A
SCHEMBL10918279 0.71 ALDH1A1 (0.38) MAPK1ALDH1A1HSD17B10MEN1KMT2A
SCHEMBL11235181 0.71 ALDH1A1 (0.38) ALDH1A1HSD17B10MEN1KMT2APOLB

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-4329460-A ANTICANCER AGENTS, ANTIVIRAL AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-05-11 US disclosed