SCHEMBL12424262

SCHEMBL12424262

CC1CCN(C(C)(C)CF)CC1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 1/20 0.34
MGLL Q99685 1/20 0.34
ACHE P22303 2/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
PRMT1 Q99873 1/20 0.33
PRMT8 Q9NR22 1/20 0.33
ALDH1A1 P00352 1/20 0.32
NPC1 O15118 1/20 0.32
SIGMAR1 Q99720 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL12422222 0.79 PHGDH (0.35) PHGDHMGLLACHECARM1PRMT6
SCHEMBL5228967 0.77 PHGDH (0.39) PHGDHMGLLACHECARM1PRMT6
SCHEMBL12384255 0.77
SCHEMBL19440696 0.76 PHGDH (0.33) PHGDHMGLLACHECARM1PRMT6
SCHEMBL23896486 0.74 ACHE (0.39) PHGDHMGLLACHECARM1PRMT6
SCHEMBL681110 0.72 PHGDH (0.36) PHGDHMGLLACHECARM1PRMT6
SCHEMBL10273153 0.71 PHGDH (0.30) PHGDHMGLL
SCHEMBL21008428 0.71 HPGD (0.35) PHGDHMGLLNPC1SIGMAR1HRH3
SCHEMBL10296630 0.70 PHGDH (0.34) PHGDHMGLLACHECARM1PRMT6
SCHEMBL72235 0.70 POLB (0.35) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461328-B2 Tricyclic heterocyclic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2013-06-11 US disclosed
US-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2011-08-18 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-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF CCNY, CCNA1, CCNA2 PHGDH 2438/4885MGLL 4475/4885ACHE 3858/4885

“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.