SCHEMBL17342203

SCHEMBL17342203

CN(C)CCN(C)c1cncc(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ BRAF P15056 2/20 0.33
▸ CYP2C19 P33261 2/20 0.33
▸ CHRNB2 P17787 1/20 0.32
▸ CHRNA4 P43681 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ HTR1D P28221 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ PIM3 Q86V86 1/20 0.31
▸ NOS3 P29474 1/20 0.30
▸ NOS1 P29475 1/20 0.30
▸ NOS2 P35228 1/20 0.30
▸ HRH3 Q9Y5N1 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
SCHEMBL12145514 0.82 BRAF (0.31) KDM4EBRAFCYP2C19CYP1A2
SCHEMBL10165035 0.77 ALDH1A1 (0.46) KDM4ECYP2C19NOS3NOS1
SCHEMBL17345678 0.77 NOS1 (0.37) KDM4EBRAFCHRNB2CHRNA4NOS3
SCHEMBL12735936 0.75 CHRNB2 (0.33) KDM4ECHRNB2CHRNA4NOS3NOS1
SCHEMBL13947613 0.73 CHRNB2 (0.37) CHRNB2CHRNA4
SCHEMBL13436334 0.72 CHRNB2 (0.32) KCNH2KDM4ECHRNB2CHRNA4HTR1D
SCHEMBL15604420 0.72 KCNH2 (0.52) KCNH2KDM4ECYP2C19CYP1A2HTR1D
SCHEMBL17996188 0.70 HDAC6 (0.35) KDM4E
SCHEMBL823824 0.70 GABRA1 (0.46) KDM4EHTR1DLMNA
SCHEMBL13068652 0.66 CHRNA7 (0.55) CYP2C19CHRNB2CHRNA4HTR1DHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150361042-A1 PRMT5 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2015-12-17 — — 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-20150361042-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT6 KCNH2 4307/4885KDM4E 33/4885BRAF 2769/4885

“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.

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