SCHEMBL18902218

SCHEMBL18902218

CCN1CCc2c(sc(NC(=O)OC(C)(C)C)c2C(=O)NCCO)C1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ KMT2A Q03164 10/20 0.45
▸ KCNH2 Q12809 2/20 0.45
▸ MITF O75030 2/20 0.45
▸ MAPT P10636 4/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ HPGD P15428 2/20 0.44
▸ RAD52 P43351 2/20 0.44
▸ GAA P10253 2/20 0.44
▸ USP2 O75604 2/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ PSMD14 O00487 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ ATM Q13315 1/20 0.42

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
SCHEMBL17018760 0.88 KMT2A (0.50) L3MBTL1KMT2AKCNH2MITFMAPT
SCHEMBL17006418 0.86 L3MBTL1 (0.52) L3MBTL1KMT2AKCNH2MAPTMEN1
SCHEMBL17018754 0.86 L3MBTL1 (0.50) L3MBTL1KMT2AKCNH2MITFMAPT
SCHEMBL17006340 0.83 MAPT (0.63) L3MBTL1KMT2AMAPTMEN1ALDH1A1
SCHEMBL17018758 0.83 RAD52 (0.45) L3MBTL1KMT2AKCNH2MITFMAPT
SCHEMBL18902186 0.81 KMT2A (0.47) L3MBTL1KMT2AKCNH2MITFMAPT
SCHEMBL17018756 0.80 ALDH1A1 (0.55) L3MBTL1KMT2AKCNH2MAPTMEN1
SCHEMBL17021999 0.78 KCNH2 (0.75) L3MBTL1KMT2AKCNH2MITFMAPT
Hydrochloric Acid SCHEMBL17006311 0.77 KCNH2 (0.75) L3MBTL1KMT2AKCNH2MITFMAPT
SCHEMBL17018757 0.74 FABP4 (0.51) —

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
EP-2900674-B1 COMPOUNDS AND METHODS FOR PREVENTING, TREATING AND/OR PROTECTING AGAINST SENSORY HAIR CELL DEATH UNIV WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2017-05-31 — — EP disclosed
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