SCHEMBL5458184

SCHEMBL5458184

CCCCCCCCCCNC(=NCCCO)NCCCC

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.47
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
GRIN3A Q8TCU5 1/20 0.47
EPHX1 P07099 6/20 0.47
NAAA Q02083 1/20 0.46
LMNA P02545 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.43
ACHE P22303 6/20 0.41
CASP2 P42575 1/20 0.40

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
SCHEMBL9996176 1.00 SIGMAR1 (0.47) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL5458828 0.98 SIGMAR1 (0.46) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9996187 0.93 NAAA (0.46) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9996188 0.93 NAAA (0.46) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6928803 0.90 SIGMAR1 (0.57) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6928799 0.90 SIGMAR1 (0.57) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7761920 0.90 SIGMAR1 (0.57) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL7756877 0.89 SIGMAR1 (0.55) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL7761662 0.89 SIGMAR1 (0.55) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
Hydrochloric Acid SCHEMBL7756850 0.89 SIGMAR1 (0.55) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8076390-B2 Antifouling polymeric agent for marine applications UVIC INDUSTRY PARTNERSHIPS INC. (CA) 2011-12-13 US claimed
US-20070129461-A1 ANTIFOULING POLYMERIC AGENT FOR MARINE APPLICATIONS UNIVERSITY OF VICTORIA INNOVATION AND DEVELOPMENT CORPORATION 2007-06-07 US claimed
US-8076390-B2 Antifouling polymeric agent for marine applications UVIC INDUSTRY PARTNERSHIPS INC. (CA) 2011-12-13 US disclosed
US-20070129461-A1 ANTIFOULING POLYMERIC AGENT FOR MARINE APPLICATIONS UNIVERSITY OF VICTORIA INNOVATION AND DEVELOPMENT CORPORATION 2007-06-07 US disclosed