SCHEMBL18902186

SCHEMBL18902186

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

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 11/20 0.47
▸ MAPT P10636 5/20 0.47
▸ MEN1 O00255 5/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ GAA P10253 3/20 0.47
▸ HPGD P15428 2/20 0.47
▸ USP2 O75604 2/20 0.45
▸ KCNH2 Q12809 2/20 0.44
▸ MITF O75030 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ PSMD14 O00487 1/20 0.42
▸ RAD52 P43351 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ ATM Q13315 1/20 0.41

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
SCHEMBL16962230 0.83 KMT2A (0.65) KMT2AMAPTMEN1ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL16962857 0.82 KMT2A (0.64) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL18902218 0.81 L3MBTL1 (0.46) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL17021999 0.78 KCNH2 (0.75) KMT2AMAPTMEN1ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL17006311 0.78 KCNH2 (0.75) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL18902175 0.75 KMT2A (0.45) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL18902296 0.75 KMT2A (0.53) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL18902187 0.74 KMT2A (0.52) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL18902113 0.72 KMT2A (0.46) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL19475192 0.72 MAPT (0.66) KMT2AMAPTMEN1ALDH1A1KDM4E

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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