SCHEMBL4539425

SCHEMBL4539425

Cc1ccc2sc3cc(C(N)=O)cc(N4CCN(C)CC4)c3c(=O)c2c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.54
THRB P10828 2/20 0.54
USP2 O75604 2/20 0.54
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 1/20 0.44
TP53 P04637 6/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
ADRB2 P07550 1/20 0.35

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
SCHEMBL5565326 0.71 KDM4E (0.47) MAPTTHRBUSP2KDM4EALDH1A1
SCHEMBL20782875 0.70 MAPT (1.00) MAPTTHRBUSP2TP53LMNA
SCHEMBL27931209 0.70 MAPT (0.39) MAPTTHRBUSP2KDM4EALDH1A1
SCHEMBL4539422 0.69 HDAC8 (0.46) MAPTTHRBUSP2KDM4EALDH1A1
SCHEMBL6976150 0.67 ALDH1A1 (0.68) MAPTKDM4EALDH1A1HSD17B10TP53
SCHEMBL487122 0.66 ALDH1A1 (0.50) MAPTKDM4EALDH1A1LMNAPOLB
SCHEMBL1609870 0.65 KDM4E (0.51) MAPTTHRBUSP2KDM4EALDH1A1
SCHEMBL22860672 0.65 MAPT (0.79) MAPTTHRBUSP2ALDH1A1TP53
SCHEMBL6981561 0.65 ALDH1A1 (0.68) MAPTKDM4EALDH1A1HSD17B10TP53
SCHEMBL28056217 0.65 ALDH1A1 (0.78) MAPTKDM4EALDH1A1HSD17B10POLB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2638027-B1 LOW-EXTRACTABLE THIOXANTHONES IGM RESINS ITALIA SRL (IT) 2016-07-13 EP disclosed
US-8933142-B2 Low-extractable thioxanthones LAMBERTI SPA (IT) 2015-01-13 US disclosed
EP-2638027-A1 LOW-EXTRACTABLE THIOXANTHONES Lamberti SpA (IT) 2013-09-18 EP disclosed
US-20130237628-A1 LOW-EXTRACTABLE THIOXANTHONES IGM RESINS ITALIA S.R.L. (IT) 2013-09-12 US disclosed
CN-103209974-A Low-extractable thioxanthones LAMBERTI SPA 2013-07-17 CN disclosed
WO-2012062692-A1 LOW-EXTRACTABLE THIOXANTHONES LAMBERTI SPA (IT) 2012-05-18 WO disclosed