SCHEMBL4929324

SCHEMBL4929324

C=CCN(CC=C)C(=O)Nc1cccc(C)c1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.51
ALDH1A1 P00352 2/20 0.50
MAPT P10636 5/20 0.48
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
HDAC9 Q9UKV0 1/20 0.48
HDAC5 Q9UQL6 1/20 0.48
HSD17B10 Q99714 2/20 0.47
POLB P06746 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
NLRP3 Q96P20 1/20 0.46
NPC1 O15118 3/20 0.46

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
SCHEMBL4936197 0.84 MAPT (0.50) NPSR1ALDH1A1MAPTHDAC3HDAC4
SCHEMBL4933159 0.79 MAPT (0.51) NPSR1ALDH1A1MAPTHDAC3HDAC4
SCHEMBL4937216 0.78 MEN1 (0.49) NPSR1ALDH1A1MAPTHSD17B10POLB
SCHEMBL4932835 0.78 KDM4E (0.53) NPSR1ALDH1A1MAPTHDAC3HDAC4
SCHEMBL4939290 0.78 NPSR1 (0.53) NPSR1ALDH1A1MAPTHDAC3HDAC4
SCHEMBL4935527 0.78 MEN1 (0.55) NPSR1ALDH1A1MAPTNPC1RAB9A
SCHEMBL4937220 0.78 KMT2A (0.55) NPSR1ALDH1A1MAPTHDAC3HDAC4
SCHEMBL2734234 0.77 NPC1 (0.55) ALDH1A1MAPTHDAC3HDAC4HDAC1
SCHEMBL11134071 0.77 NPSR1 (0.49) NPSR1ALDH1A1MAPTHDAC3HDAC4
SCHEMBL3434565 0.77 MAPT (0.56) NPSR1ALDH1A1MAPTPOLBNPC1

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-20080308492-A1 Filter Medium for Technical Applications, and Method for the Production Thereof MAHLE INTERNATIONAL GMBH (DE) 2008-12-18 US claimed
US-20080308492-A1 Filter Medium for Technical Applications, and Method for the Production Thereof MAHLE INTERNATIONAL GMBH (DE) 2008-12-18 US disclosed