SCHEMBL4144926

SCHEMBL4144926

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

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.37
MMP12 P39900 1/20 0.37
LIPG Q9Y5X9 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SRD5A1 P18405 1/20 0.32
SRD5A2 P31213 1/20 0.32
NR1I2 O75469 1/20 0.32
FAAH O00519 4/20 0.32
GLP1R P43220 1/20 0.31
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
CPT2 P23786 1/20 0.30
CPT1A P50416 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
SCHEMBL4144927 1.00 PRKCA (0.37) PRKCAMMP12LIPGKDM4ESRD5A1
SCHEMBL4143720 0.90 PRKCA (0.42) PRKCAMMP12LIPGKDM4ENR1I2
SCHEMBL4143716 0.90 PRKCA (0.42) PRKCAMMP12LIPGKDM4ENR1I2
SCHEMBL4149435 0.90 NR1I2 (0.39) PRKCAMMP12NR1I2SMN1; SMN2ESR1
SCHEMBL4149438 0.90 NR1I2 (0.39) PRKCAMMP12NR1I2SMN1; SMN2ESR1
SCHEMBL4161529 0.88 CPT2 (0.35) PRKCAMMP12LIPGNR1I2CPT2
SCHEMBL4161530 0.88 CPT2 (0.35) PRKCAMMP12LIPGNR1I2CPT2
SCHEMBL4152231 0.86 PRKCA (0.40) PRKCAMMP12SRD5A1SRD5A2GLP1R
SCHEMBL4152229 0.86 PRKCA (0.40) PRKCAMMP12SRD5A1SRD5A2GLP1R
SCHEMBL4152557 0.84 EGFR (0.33) PRKCAMMP12LIPGNR1I2

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 PRKCA 4320/4885MMP12 3563/4885LIPG 4171/4885

“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.