SCHEMBL6887967

SCHEMBL6887967

CCCN(CCC)C(C)N1CCNCC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.36
OPRD1 P41143 4/20 0.32
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
OPRM1 P35372 2/20 0.30
CHRM5 P08912 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL1627655 0.83 OPRD1 (0.36) SIGMAR1OPRD1SLC6A2SLC6A4OPRM1
SCHEMBL28802525 0.82 SLC6A2 (0.31) SLC6A2SLC6A4
SCHEMBL10522315 0.72 MEN1 (0.34) OPRD1SLC6A2SLC6A4CHRM5CHRM3
SCHEMBL997411 0.72 MEN1 (0.34) OPRD1SLC6A2SLC6A4CHRM5CHRM3
SCHEMBL28273095 0.70 CHRM2 (0.34)
SCHEMBL3822012 0.68 SIGMAR1 (0.36) SIGMAR1OPRD1SLC6A2SLC6A4GNAI3
SCHEMBL19491089 0.68 SLC6A2 (0.33) SIGMAR1OPRD1SLC6A2SLC6A4CHRM5
SCHEMBL3534793 0.67 KDM4E (0.37) SIGMAR1OPRD1SLC6A2SLC6A4GNAI3
SCHEMBL2551138 0.67 KDM4E (0.37) SIGMAR1OPRD1SLC6A2SLC6A4GNAI3
SCHEMBL13419180 0.67 KDM4E (0.37) SIGMAR1OPRD1SLC6A2SLC6A4GNAI3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6713146-B2 SINGLY RECORDABLE COMPACT DISC (CD-R) BAYER AKTIENGESELLSCHAFT (DE) 2004-03-30 US claimed
EP-1322906-A1 OPTICAL DATA STORAGE DEVICE CONTAINING A CO-PHTHALOCYANIN COMPLEX IN THE OPTICALLY WRITABLE INFORMATION LAYER Bayer Aktiengesellschaft (DE) 2003-07-02 EP claimed
US-20020127366-A1 Optical data stores containing a Co-phthalocyanine complex in the information layer recordable using light LANXESS DEUTSCHLAND GMBH (DE) 2002-09-12 US claimed
WO-2002025205-A1 OPTICAL DATA STORAGE DEVICE CONTAINING A CO-PHTHALOCYANIN COMPLEX IN THE OPTICALLY WRITABLE INFORMATION LAYER BAYER AKTIENGESELLSCHAFT (DE) 2002-03-28 WO claimed
US-6713146-B2 SINGLY RECORDABLE COMPACT DISC (CD-R) BAYER AKTIENGESELLSCHAFT (DE) 2004-03-30 US disclosed
EP-1322906-A1 OPTICAL DATA STORAGE DEVICE CONTAINING A CO-PHTHALOCYANIN COMPLEX IN THE OPTICALLY WRITABLE INFORMATION LAYER Bayer Aktiengesellschaft (DE) 2003-07-02 EP disclosed
US-20020127366-A1 Optical data stores containing a Co-phthalocyanine complex in the information layer recordable using light LANXESS DEUTSCHLAND GMBH (DE) 2002-09-12 US disclosed
WO-2002025205-A1 OPTICAL DATA STORAGE DEVICE CONTAINING A CO-PHTHALOCYANIN COMPLEX IN THE OPTICALLY WRITABLE INFORMATION LAYER BAYER AKTIENGESELLSCHAFT (DE) 2002-03-28 WO disclosed