SCHEMBL8561985

SCHEMBL8561985

CCOC(=O)c1cc(Sc2ccc(N)cc2)nc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 9/20 0.63
RXFP1 Q9HBX9 6/20 0.63
LMNA P02545 5/20 0.63
NCOA1 Q15788 1/20 0.57
NCOA3 Q9Y6Q9 1/20 0.57
ALDH1A1 P00352 1/20 0.55
MAPT P10636 1/20 0.55
MEN1 O00255 1/20 0.54
HTT P42858 1/20 0.54
KMT2A Q03164 1/20 0.54
CCR6 P51684 1/20 0.49
KDM4E B2RXH2 1/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL31133520 0.76 KDM4E (0.72) LMNAALDH1A1MAPTMEN1HTT
SCHEMBL5810312 0.76 KDM4E (0.72) LMNAALDH1A1MAPTMEN1HTT
SCHEMBL2918797 0.76 KDM4E (0.67) TP53LMNAALDH1A1MAPTMEN1
SCHEMBL13725701 0.76 KDM4E (0.64) TP53LMNAALDH1A1MAPTMEN1
SCHEMBL31531878 0.75 KDM4E (0.79) TP53LMNAALDH1A1MAPTMEN1
SCHEMBL10678483 0.75 KDM4E (0.79) TP53LMNAALDH1A1MAPTMEN1
SCHEMBL7116623 0.74 LMNA (0.49) TP53RXFP1LMNAALDH1A1MAPT
SCHEMBL13576788 0.74 KDM4E (0.55) LMNAALDH1A1MAPTMEN1HTT
SCHEMBL3330317 0.74 ALDH1A1 (0.60) LMNAALDH1A1MAPTMEN1KMT2A
SCHEMBL8562988 0.74 KDM4E (0.72) ALDH1A1MAPTMEN1HTTKMT2A

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-5814646-A TREATING THE PROGRESSION OF ALZHEIMER'S DISEASE, BRAIN DISORDERS ELI LILLY AND COMPANY (US) 1998-09-29 US disclosed
US-5624937-A TREATMENT OF ALZHEIMER'S DISEASE ELI LILLY AND COMPANY (US) 1997-04-29 US disclosed