SCHEMBL9469795

SCHEMBL9469795

CCOC(=O)C(CCCCCCOc1ccc(N)cc1)C(=O)OCC

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
L3MBTL1 Q9Y468 6/20 0.68
MAPT P10636 3/20 0.68
CRHBP P24387 1/20 0.66
CRHR2 Q13324 1/20 0.66
TDP1 Q9NUW8 7/20 0.65
MAPK1 P28482 4/20 0.59
TSHR P16473 3/20 0.54
ALDH1A1 P00352 2/20 0.54
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
GAA P10253 1/20 0.44
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAOA P21397 1/20 0.44

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
SCHEMBL14097352 0.87 MEN1 (0.71) MEN1KMT2AL3MBTL1MAPTCRHBP
SCHEMBL7432275 0.87 MEN1 (0.91) MEN1KMT2AL3MBTL1MAPTCRHBP
SCHEMBL5883644 0.86 MEN1 (0.69) MEN1KMT2AL3MBTL1MAPTCRHBP
SCHEMBL7437760 0.86 MEN1 (0.69) MEN1KMT2AL3MBTL1MAPTCRHBP
SCHEMBL8080157 0.85 TDP1 (0.88) MEN1KMT2AL3MBTL1MAPTCRHBP
SCHEMBL11022539 0.85 TDP1 (0.88) MEN1KMT2AL3MBTL1MAPTCRHBP
SCHEMBL7571535 0.85 TDP1 (0.88) MEN1KMT2AL3MBTL1MAPTCRHBP
SCHEMBL7429207 0.84 TDP1 (0.91) MEN1KMT2AL3MBTL1MAPTCRHBP
SCHEMBL222442 0.82 MEN1 (0.82) MEN1KMT2AL3MBTL1MAPTCRHBP
SCHEMBL9469780 0.81 KMT2A (0.63) MEN1KMT2AL3MBTL1MAPTCRHBP

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-5207952-A Polyesters with pendant side chains UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1993-05-04 US disclosed