SCHEMBL4151555

SCHEMBL4151555

CN(C)CCN1CCn2c(c([C@@H]3CCCC[C@H]3F)c3ccc(C(=O)O)cc32)-c2ccc(OCc3ccccc3)cc2C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.39
MMP12 P39900 1/20 0.39
SLC6A5 Q9Y345 2/20 0.38
EGFR P00533 2/20 0.35
GHSR Q92847 2/20 0.35
LTB4R Q15722 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
POLB P06746 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA5 P30532 1/20 0.34
CHRNA7 P36544 1/20 0.34
CHRNA4 P43681 1/20 0.34
KDM2B Q8NHM5 1/20 0.34

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
SCHEMBL4151551 1.00 PRKCA (0.39) PRKCAMMP12SLC6A5EGFRGHSR
SCHEMBL4156442 0.94 SLC6A5 (0.38) PRKCAMMP12SLC6A5EGFR
SCHEMBL4156439 0.94 SLC6A5 (0.38) PRKCAMMP12SLC6A5EGFR
SCHEMBL4149821 0.93 GHSR (0.38) PRKCAMMP12EGFRGHSRCNR1
SCHEMBL4149818 0.93 GHSR (0.38) PRKCAMMP12EGFRGHSRCNR1
SCHEMBL4139612 0.93 PRMT5 (0.36) PRKCAMMP12SLC6A5
SCHEMBL4139614 0.93 PRMT5 (0.36) PRKCAMMP12SLC6A5
SCHEMBL4146072 0.92 PRKCA (0.38) PRKCAMMP12SLC6A5
SCHEMBL4146064 0.92 PRKCA (0.38) PRKCAMMP12SLC6A5
SCHEMBL4143500 0.92 KDM4E (0.40) EGFRCNR1CNR2

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 3563/4885SLC6A5 2329/4885

“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.