SCHEMBL21322470

SCHEMBL21322470

CNC(=O)C(C)(C)CCOC(C)(C)CCNC(=S)NCC(=O)NC(CCCNC(N)=O)C(C)=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SIRT5 Q9NXA8 1/20 0.32
▸ C3AR1 Q16581 1/20 0.31

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
SCHEMBL24860409 0.79 C3AR1 (0.38) SIRT5C3AR1
SCHEMBL19203408 0.77 SIRT5 (0.41) SIRT5C3AR1
SCHEMBL19203553 0.76 SIRT5 (0.37) SIRT5C3AR1
SCHEMBL21322742 0.76 SIRT5 (0.37) SIRT5C3AR1
SCHEMBL22767952 0.75 — —
SCHEMBL19203577 0.75 — —
SCHEMBL20793387 0.70 C3AR1 (0.41) SIRT5C3AR1
SCHEMBL20375713 0.70 C3AR1 (0.41) SIRT5C3AR1
SCHEMBL18051173 0.70 C3AR1 (0.41) SIRT5C3AR1
SCHEMBL21322508 0.69 SIRT5 (0.37) SIRT5C3AR1

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-3273998-B1 MAYTANSINOID DERIVATIVES, CONJUGATES THEREOF, AND METHODS OF USE REGENERON PHARMA (US) 2019-09-04 — — EP disclosed
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