SCHEMBL16776200

SCHEMBL16776200

Cc1ccc(-c2ccc3c(n2)N(C(=O)Nc2cccnn2)[C@H](C)CCCN3)cn1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 16/20 0.39
▸ KCNH2 Q12809 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.35
▸ CYP3A4 P08684 1/20 0.34
▸ PORCN Q9H237 1/20 0.34
▸ WNT3A P56704 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
SCHEMBL16776198 0.91 GRM5 (0.39) KCNH2HRH3WNT3A
SCHEMBL16776190 0.90 FAAH (0.37) FAAHKCNH2HRH3CYP3A4PORCN
SCHEMBL16776014 0.85 GRM5 (0.40) KCNH2HRH3WNT3A
SCHEMBL16776247 0.85 ABL1 (0.37) FAAH
SCHEMBL16776148 0.83 GABRA1 (0.38) FAAHCYP3A4
SCHEMBL16776121 0.83 PIM1 (0.35) FAAH
SCHEMBL16776209 0.83 KCNH2 (0.42) FAAHKCNH2HRH3
SCHEMBL16776235 0.82 NPC1 (0.38) KCNH2HRH3
SCHEMBL16776263 0.82 FAAH (0.39) FAAH
SCHEMBL16776474 0.82 FAAH (0.39) FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150152108-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2015-06-04 — — US disclosed
US-20150152108-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2015-06-04 — — 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-20150152108-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 FAAH 977/4885KCNH2 4052/4885HRH3 2288/4885

“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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