SCHEMBL4153349

SCHEMBL4153349

CN(C)CC(=O)N1CCn2c(c([C@@H]3CCCC[C@H]3F)c3ccc(C(=O)O)cc32)-c2ccc(OCc3cccnc3)cc2C1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR132 Q9UNW8 3/20 0.35
GPR84 Q9NQS5 1/20 0.34
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
CYP8B1 Q9UNU6 1/20 0.33
PRKCA P17252 1/20 0.33
MMP12 P39900 1/20 0.33
SLC6A5 Q9Y345 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
LIPG Q9Y5X9 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
SCHEMBL4153345 1.00 GPR132 (0.35) GPR132GPR84PRMT5WDR77NPC1
SCHEMBL4152557 0.92 EGFR (0.33) GPR84PRMT5WDR77NPC1RAB9A
SCHEMBL4152562 0.92 EGFR (0.33) GPR84PRMT5WDR77NPC1RAB9A
SCHEMBL4151297 0.89 PRKCA (0.35) GPR84PRKCAMMP12HRH3LIPG
SCHEMBL4151304 0.89 PRKCA (0.35) GPR84PRKCAMMP12HRH3LIPG
SCHEMBL4155759 0.89 PRMT5 (0.37) GPR132GPR84PRMT5WDR77NPC1
SCHEMBL4155762 0.89 PRMT5 (0.37) GPR132GPR84PRMT5WDR77NPC1
SCHEMBL4139614 0.89 PRMT5 (0.36) GPR132GPR84PRMT5WDR77NPC1
SCHEMBL4139612 0.89 PRMT5 (0.36) GPR132GPR84PRMT5WDR77NPC1
SCHEMBL4161529 0.88 CPT2 (0.35) PRKCAMMP12LIPG

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 GPR132 2681/4885GPR84 2204/4885PRMT5 3377/4885

“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.