SCHEMBL16776375

SCHEMBL16776375

C[C@@H]1CNc2ccc(-c3cccc(Cl)c3)nc2N(C(=O)Nc2cccnn2)C1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 12/20 0.38
▸ CNR2 P34972 2/20 0.38
▸ SIRT2 Q8IXJ6 1/20 0.38
▸ FFAR2 O15552 1/20 0.35
▸ HSD11B1 P28845 1/20 0.35
▸ TP53 P04637 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ BRAF P15056 1/20 0.34
▸ KDM5B Q9UGL1 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
SCHEMBL16785583 0.89 FAAH (0.38) FAAHCNR2SIRT2FFAR2TP53
SCHEMBL16776372 0.89 CNR2 (0.51) FAAHCNR2SIRT2HSD11B1TP53
SCHEMBL16776374 0.85 TSHR (0.46) TP53GAASMN1; SMN2BRAF
SCHEMBL16776373 0.83 FGFR4 (0.40) FAAHCNR2BRAF
SCHEMBL16776378 0.83 P2RY1 (0.39) CNR2HSD11B1TP53SMN1; SMN2BRAF
SCHEMBL16776371 0.82 BRAF (0.38) CNR2TP53GAASMN1; SMN2BRAF
SCHEMBL16776381 0.82 ABL1 (0.36) CNR2FFAR2HSD11B1SMN1; SMN2KDM5B
SCHEMBL16776380 0.79 BRAF (0.46) TP53GAASMN1; SMN2BRAF
SCHEMBL19365812 0.76 TP53 (0.42) FAAHCNR2SIRT2TP53GAA
SCHEMBL16776347 0.75 ALOX15 (0.38) FAAHSIRT2TP53SMN1; SMN2BRAF

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-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 977/4885CNR2 2514/4885SIRT2 3/4885

“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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