SCHEMBL3811595

SCHEMBL3811595

CCN(CC)C(=O)COCCc1ccc2c(c1)CCC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.44
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ RXRB P28702 3/20 0.40
▸ DUSP3 P51452 1/20 0.39
▸ PTPN5 P54829 1/20 0.39
▸ PTPN11 Q06124 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ RXRA P19793 2/20 0.38
▸ RXRG P48443 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KMT2A Q03164 1/20 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
SCHEMBL2097540 0.82 NPC1 (0.41) ALDH1A1NPC1RAB9ARXRBALOX15
SCHEMBL3811959 0.81 ALOX15 (0.55) ALDH1A1NPC1RAB9ARXRBALOX15
SCHEMBL3818290 0.76 HTT (0.47) ALDH1A1NPC1RAB9ASLC6A2SLC6A4
SCHEMBL3812017 0.76 BIRC5 (0.43) ALDH1A1TSHRTDP1KMT2A
Hydrochloric Acid SCHEMBL3817536 0.75 BIRC5 (0.43) ALDH1A1TSHRTDP1KMT2A
SCHEMBL7984662 0.74 RXRB (0.46) ALDH1A1NPC1RAB9ARXRBALOX15
SCHEMBL6769310 0.72 SIGMAR1 (0.47) TRPM8ALDH1A1SLC6A2SLC6A4TSHR
SCHEMBL3808077 0.72 ALDH1A1 (0.39) TRPM8ALDH1A1SLC6A2SLC6A4TSHR
SCHEMBL8690554 0.72 SLC6A4 (0.42) ALDH1A1SLC6A4RXRBRXRARXRG
SCHEMBL3812957 0.72 TPSAB1 (0.42) NPC1RAB9ARXRBALOX15TSHR

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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