SCHEMBL10052290

SCHEMBL10052290

CC(C)CCN1CCCC(CC(C)C)C1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.37
PRMT6 Q96LA8 1/20 0.37
ROCK2 O75116 2/20 0.36
ROCK1 Q13464 2/20 0.36
KDM4E B2RXH2 1/20 0.33
CCR5 P51681 1/20 0.33
DPP4 P27487 1/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
DRD4 P21917 1/20 0.33
DRD5 P21918 1/20 0.33
DRD3 P35462 1/20 0.33
ACHE P22303 1/20 0.32
CHRM5 P08912 1/20 0.32
ADRA2C P18825 1/20 0.32
HTR7 P34969 1/20 0.32

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
SCHEMBL25098463 0.86 CARM1 (0.34) CARM1PRMT6ROCK2ROCK1KDM4E
SCHEMBL25786362 0.86 ALDH1A1 (0.37) CARM1PRMT6KDM4ECCR5
SCHEMBL18082542 0.85 BCHE (0.42) CARM1PRMT6ROCK2ROCK1KDM4E
SCHEMBL10076884 0.85 BCHE (0.42) CARM1PRMT6ROCK2ROCK1KDM4E
SCHEMBL22020562 0.83 CYP3A4 (0.35) KDM4EDRD2DRD3ACHECHRM5
SCHEMBL9925435 0.83 CYP3A4 (0.35) KDM4EDRD2DRD3ACHECHRM5
SCHEMBL26345081 0.83 PIK3CD (0.41) CARM1PRMT6KDM4EACHECHRM5
SCHEMBL7797268 0.82 CHRM5 (0.52) CARM1PRMT6ROCK2ROCK1KDM4E
SCHEMBL13077 0.81 KDM4E (0.50) KDM4EHTR7
SCHEMBL13995508 0.81 KDM4E (0.50) KDM4EHTR7

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-8178531-B2 Antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2012-05-15 US disclosed
US-20110218175-A1 ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2011-09-08 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-20110218175-A1 ANTIVIRAL AGENTS EIF2AK2, HAVCR2, MAVS CARM1 4372/4885PRMT6 2646/4885ROCK2 3445/4885

“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.