SCHEMBL4392316

SCHEMBL4392316

CCCN1CCN(CCCCN)CC1

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 2/20 0.52
GNAO1 P09471 2/20 0.52
GNAI1 P63096 2/20 0.52
SIGMAR1 Q99720 1/20 0.48
ALOX15 P16050 1/20 0.48
KEAP1 Q14145 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ACE2 Q9BYF1 1/20 0.43
DNM1 Q05193 1/20 0.42

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
SCHEMBL1861653 0.93 KEAP1 (0.54) GNAI3GNAO1GNAI1SIGMAR1ALOX15
SCHEMBL4944738 0.91 GNAI3 (0.63) GNAI3GNAO1GNAI1DNM1
SCHEMBL4389217 0.91 GNAI3 (0.57) GNAI3GNAO1GNAI1SIGMAR1ALOX15
SCHEMBL6656231 0.87 GNAI3 (0.56) GNAI3GNAO1GNAI1SIGMAR1
SCHEMBL1615517 0.87 ALOX15 (0.61) SIGMAR1ALOX15KEAP1SMN1; SMN2ACE2
SCHEMBL4666999 0.87
SCHEMBL6277287 0.86 GNAI3 (0.63) GNAI3GNAO1GNAI1ALOX15KEAP1
SCHEMBL856819 0.86 SIGMAR1 (0.48) GNAI3GNAO1GNAI1SIGMAR1ALOX15
SCHEMBL6658139 0.85 GNAI3 (0.60) GNAI3GNAO1GNAI1SIGMAR1
SCHEMBL16233071 0.85 GNAI3 (0.60) GNAI3GNAO1GNAI1SIGMAR1

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-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME MITSUI CHEMICALS, INC. (JP) 2009-12-10 US disclosed
US-20070054084-A1 Optical recording medium and compound used for the same MITSUI CHEMICALS, INC. (JP) 2007-03-08 US disclosed
EP-1672626-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED IN THE OPTICAL RECORDING MEDIUM Mitsui Chemicals, Inc. (JP) 2006-06-21 EP disclosed
US-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME CACNA1B, KCNN4, KCNN2 GNAI3 881/4885GNAO1 191/4885GNAI1 1073/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.