SCHEMBL11243898

SCHEMBL11243898

CCCCOC1NC(=O)NC(=O)C1(F)C(=O)OC

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
TP53 P04637 1/20 0.33
ALDH1A1 P00352 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.31
MMP2 P08253 3/20 0.31
MMP9 P14780 3/20 0.31
MMP8 P22894 2/20 0.31
MMP13 P45452 2/20 0.31
MMP3 P08254 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL11248743 0.95 HSD17B10 (0.37) LMNAMEN1KMT2AHSD17B10MMP2
SCHEMBL11257874 0.90 MEN1 (0.36) LMNAALDH1A1TDP1MEN1KMT2A
SCHEMBL11233995 0.87 LMNA (0.35) LMNAALDH1A1TDP1MEN1KMT2A
SCHEMBL11236916 0.85 HSD17B10 (0.41) LMNATP53ALDH1A1MEN1KMT2A
SCHEMBL11230814 0.84 HSD17B10 (0.40) LMNAALDH1A1TDP1MEN1KMT2A
SCHEMBL11243223 0.84 HSD17B10 (0.40) LMNAALDH1A1TDP1MEN1KMT2A
SCHEMBL11238643 0.84 HSD17B10 (0.40) LMNAALDH1A1TDP1MEN1KMT2A
SCHEMBL11250294 0.84 HSD17B10 (0.40) LMNAALDH1A1TDP1MEN1KMT2A
SCHEMBL11382693 0.84 TSHR (0.38) LMNAALDH1A1TDP1MEN1KMT2A
SCHEMBL11253951 0.82 HSD17B10 (0.40) LMNATP53ALDH1A1TDP1MEN1

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