SCHEMBL4139614

SCHEMBL4139614

CN(C)CCN1CCn2c(c([C@@H]3CCCC[C@H]3F)c3ccc(C(=O)O)cc32)-c2ccc(OCc3cccnc3)cc2C1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
PRKCA P17252 1/20 0.35
MMP12 P39900 1/20 0.35
ALDH1A1 P00352 1/20 0.34
SLC6A5 Q9Y345 2/20 0.34
GPR84 Q9NQS5 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
GPR132 Q9UNW8 1/20 0.33
CHRM4 P08173 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1B1 Q16678 1/20 0.33
MET P08581 1/20 0.33

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
SCHEMBL4139612 1.00 PRMT5 (0.36) PRMT5WDR77PRKCAMMP12ALDH1A1
SCHEMBL4141153 0.94 PRMT5 (0.35) PRMT5WDR77SLC6A5GPR84HRH3
SCHEMBL4141149 0.94 PRMT5 (0.35) PRMT5WDR77SLC6A5GPR84HRH3
SCHEMBL4151551 0.93 PRKCA (0.39) PRKCAMMP12SLC6A5
SCHEMBL4151555 0.93 PRKCA (0.39) PRKCAMMP12SLC6A5
SCHEMBL4156439 0.92 SLC6A5 (0.38) PRMT5WDR77PRKCAMMP12SLC6A5
SCHEMBL4156442 0.92 SLC6A5 (0.38) PRMT5WDR77PRKCAMMP12SLC6A5
SCHEMBL4149800 0.91 PRMT5 (0.39) PRMT5WDR77SLC6A5GPR84HRH3
SCHEMBL4149796 0.91 PRMT5 (0.39) PRMT5WDR77SLC6A5GPR84HRH3
SCHEMBL4155762 0.90 PRMT5 (0.37) PRMT5WDR77SLC6A5GPR84HRH3

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-20090136449-A1 Tetracyclic Indole Derivatives as Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-05-28 US claimed

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-20090136449-A1 Tetracyclic Indole Derivatives as Antiviral Agents IDO1, IDO2, ZC3HAV1 PRMT5 3377/4885WDR77 3311/4885PRKCA 4320/4885

“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.