SCHEMBL6896450

SCHEMBL6896450

CCCCCCCCCCCCCCCCCCCC(=O)NCCCN

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 2/20 0.73
FAAH O00519 5/20 0.68
CASP2 P42575 1/20 0.66
DNM1 Q05193 2/20 0.64
NAAA Q02083 1/20 0.61
EPHX2 P34913 3/20 0.57
HSP90AA1 P07900 1/20 0.53
SELP P16109 1/20 0.53
KDM4E B2RXH2 1/20 0.53
LPAR1 Q92633 1/20 0.53

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
SCHEMBL117118 1.00 SLC6A5 (0.73) SLC6A5FAAHCASP2DNM1NAAA
SCHEMBL19861379 1.00 SLC6A5 (0.73) SLC6A5FAAHCASP2DNM1NAAA
SCHEMBL4662738 1.00 SLC6A5 (0.73) SLC6A5FAAHCASP2DNM1NAAA
SCHEMBL115770 1.00 SLC6A5 (0.73) SLC6A5FAAHCASP2DNM1NAAA
SCHEMBL248585 1.00 SLC6A5 (0.73) SLC6A5FAAHCASP2DNM1NAAA
SCHEMBL24682149 1.00 SLC6A5 (0.73) SLC6A5FAAHCASP2DNM1NAAA
SCHEMBL115809 1.00 SLC6A5 (0.73) SLC6A5FAAHCASP2DNM1NAAA
SCHEMBL115688 1.00 SLC6A5 (0.73) SLC6A5FAAHCASP2DNM1NAAA
Hydrochloric Acid SCHEMBL28641720 0.98 SLC6A5 (0.74) SLC6A5FAAHCASP2DNM1NAAA
SCHEMBL28470408 0.98 SLC6A5 (0.71) SLC6A5FAAHCASP2DNM1NAAA

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-1010717-B1 Oil-in-water emulsion of organopolysiloxane and method for the preparation thereof SHINETSU CHEMICAL CO (JP) 2004-09-22 EP claimed
US-6316545-B1 USEFUL AS AN ADJUVANT INGREDIENT IN TOILETRY PREPARATIONS FOR HAIR-CARE TREATMENT, POLISHING AGENTS, MOLD-RELEASE AGENTS, FABRIC-FINISHING AGENTS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-11-13 US claimed
EP-1010717-A2 Oil-in-water emulsion of organopolysiloxane and method for the preparation thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-06-21 EP claimed
EP-1010717-B1 Oil-in-water emulsion of organopolysiloxane and method for the preparation thereof SHINETSU CHEMICAL CO (JP) 2004-09-22 EP disclosed
US-6316545-B1 USEFUL AS AN ADJUVANT INGREDIENT IN TOILETRY PREPARATIONS FOR HAIR-CARE TREATMENT, POLISHING AGENTS, MOLD-RELEASE AGENTS, FABRIC-FINISHING AGENTS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-11-13 US disclosed
EP-1010717-A2 Oil-in-water emulsion of organopolysiloxane and method for the preparation thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-06-21 EP disclosed