SCHEMBL3812920

SCHEMBL3812920

CN(CCOC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)CCl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.42
▸ CYP2D6 P10635 3/20 0.41
▸ BLM P54132 1/20 0.41
▸ ALDH1A1 P00352 8/20 0.40
▸ RAB9A P51151 6/20 0.40
▸ HTT P42858 4/20 0.40
▸ NPC1 O15118 4/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ CHRM2 P08172 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ PAX8 Q06710 2/20 0.38

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
SCHEMBL27174647 0.77 SMN1; SMN2 (0.51) ALDH1A1RAB9ANPC1KMT2APOLB
SCHEMBL1692471 0.72 ALDH1A1 (0.39) ALDH1A1RAB9AHTTNPC1KMT2A
SCHEMBL2062823 0.71 RAB9A (0.69) ALDH1A1RAB9AHTTNPC1KMT2A
SCHEMBL8733650 0.71 ESR2 (0.47) ALDH1A1RAB9AHTTNPC1KMT2A
SCHEMBL23777353 0.70 SLC6A11 (0.48) KIF11ALDH1A1KMT2APOLBMEN1
SCHEMBL3573169 0.69 KIF11 (0.63) KIF11ALDH1A1CYP2C9TSHRCYP2C19
SCHEMBL9040289 0.69 KIF11 (0.53) KIF11HDAC6CYP3A4CYP1A2CYP2C9
SCHEMBL30381006 0.69 L3MBTL1 (0.43) KIF11HDAC6CYP2D6BLMALDH1A1
SCHEMBL30380977 0.69 L3MBTL1 (0.43) KIF11HDAC6CYP2D6BLMALDH1A1
SCHEMBL11275984 0.69 KIF11 (0.74) KIF11ALDH1A1CYP2C9TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1186594-B1 N-ALKOXYALKYL-N,N-DIALKYLAMINE DERIVATIVES OR SALTS THEREOF, AND REMEDIES FOR NERVE DEGENERATION DISEASES CONTAINING THE SAME TOYAMA CHEMICAL CO LTD (JP) 2009-08-05 — — EP disclosed
US-6797726-B1 N-alkoxyalkyl-N,N-dialkylamine derivatives or salts thereof, and remedies for nerve degeneration diseases containing the same TOYAMA CHEMICAL CO., LTD. (JP) 2004-09-28 — — US disclosed
EP-1186594-A1 N-ALKOXYALKYL-N,N-DIALKYLAMINE DERIVATIVES OR SALTS THEREOF, AND REMEDIES FOR NERVE DEGENERATION DISEASES CONTAINING THE SAME TOYAMA CHEMICAL CO., LTD. (JP) 2002-03-13 — — EP disclosed
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