SCHEMBL19225872

SCHEMBL19225872

CO[C@@H]1CCN(C(=O)CNc2cc(C)ccc2C(=N)C(N)=O)[C@@H]1C(=O)NC[C@H]1CC1(Cl)Cl

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 10/20 0.42
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 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
SCHEMBL19225941 0.92 CFD (0.42) CFD
SCHEMBL19225866 0.90 CFD (0.40) CFD
SCHEMBL19225958 0.85 CFD (0.40) CFDNPC1RAB9A
SCHEMBL15602038 0.79 CFD (0.40) CFDNPC1RAB9A
SCHEMBL15602110 0.78 CFD (0.58) CFD
SCHEMBL19225833 0.78 CFD (0.41) CFD
SCHEMBL19225838 0.76 CFD (0.39) CFD
SCHEMBL15602099 0.75 CFD (0.57) CFD
SCHEMBL19158750 0.74 CFD (0.40) CFD
SCHEMBL19225883 0.73 F2 (0.42) CFD

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
EP-2867225-B1 PYRROLIDINE DERIVATIVES AND THEIR USE AS COMPLEMENT PATHWAY MODULATORS NOVARTIS AG (CH) 2017-08-09 — — EP disclosed
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