SCHEMBL12295013

SCHEMBL12295013

CCC(O)(CC)c1ccc(N2CCC(Cc3ccccc3N3CCN([11CH3])CC3)C2=O)cn1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 6/20 0.42
BRD9 Q9H8M2 12/20 0.40
BRD4 O60885 4/20 0.40
BRPF1 P55201 3/20 0.40
BRD7 Q9NPI1 2/20 0.38
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
DRD3 P35462 1/20 0.36
WEE1 P30291 1/20 0.34
PLK1 P53350 1/20 0.34

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
SCHEMBL1740171 1.00 ROCK2 (0.42) ROCK2BRD9BRD4BRPF1BRD7
SCHEMBL12295015 1.00 ROCK2 (0.42) ROCK2BRD9BRD4BRPF1BRD7
SCHEMBL1738777 1.00 ROCK2 (0.42) ROCK2BRD9BRD4BRPF1BRD7
SCHEMBL12295017 1.00 ROCK2 (0.42) ROCK2BRD9BRD4BRPF1BRD7
SCHEMBL1738655 1.00 ROCK2 (0.42) ROCK2BRD9BRD4BRPF1BRD7
SCHEMBL1738670 0.91 ROCK2 (0.40) ROCK2BRD9BRD4BRPF1BRD7
SCHEMBL1737753 0.91 ROCK2 (0.40) ROCK2BRD9BRD4BRPF1BRD7
SCHEMBL1737725 0.91 ROCK2 (0.40) ROCK2BRD9BRD4BRPF1BRD7
SCHEMBL12327970 0.91 ROCK2 (0.41) ROCK2HTR2C
SCHEMBL12327971 0.91 ROCK2 (0.41) ROCK2HTR2C

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-8012969-B2 Radiopharmaceutical for positron emission tomography; imaging brain tissue; labeled serotonin type 1B (5HT1B) receptor ligands GE HEALTHCARE LIMITED (GB) 2011-09-06 US disclosed
US-20080206137-A1 11C-Labeled Benzyl-Lactam Compounds and Their Use as Imaging Agents GE HEALTHCARE LIMITED (GB) 2008-08-28 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-20080206137-A1 11C-Labeled Benzyl-Lactam Compounds and Their Use as Imaging Agents TMEM14C, QPCT, PAICS ROCK2 2938/4885BRD9 639/4885BRD4 102/4885

“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.