SCHEMBL20806109

SCHEMBL20806109

CCc1ccc(NC(=O)C(CCCNC(N)=O)NC(=O)C(C)C(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 2/20 0.45
▸ HTT P42858 1/20 0.42
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CRHBP P24387 1/20 0.39
▸ CRHR2 Q13324 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ SIRT2 Q8IXJ6 7/20 0.39
▸ SIRT1 Q96EB6 7/20 0.39
▸ SIRT3 Q9NTG7 3/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ATM Q13315 1/20 0.38

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
SCHEMBL24611248 1.00 FURIN (0.45) FURINHTTLMNAMAPTL3MBTL1
SCHEMBL21157965 0.91 FURIN (0.38) FURINHTTSMN1; SMN2SIRT2SIRT1
SCHEMBL19302502 0.90 FURIN (0.45) FURINHTTLMNAMAPTL3MBTL1
SCHEMBL27291528 0.88 FURIN (0.49) FURINHTTLMNAMAPTL3MBTL1
SCHEMBL20803558 0.88 SIRT2 (0.41) FURINHTTSMN1; SMN2SIRT2SIRT1
SCHEMBL22064590 0.87 FURIN (0.51) FURINHTTLMNAL3MBTL1TP53
SCHEMBL20149172 0.87 FURIN (0.49) FURINHTTLMNAMAPTL3MBTL1
SCHEMBL24822727 0.86 SIRT2 (0.44) HTTSMN1; SMN2SIRT2SIRT1SIRT3
SCHEMBL17086814 0.86 SIRT2 (0.44) HTTSIRT2SIRT1SIRT3
SCHEMBL24086378 0.86 SPHK1 (0.49) HTTLMNAMAPTL3MBTL1CRHBP

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
WO-2019051489-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF DISEASE SPEROVIE BIOSCIENCES, INC. (US) 2019-03-14 — — WO disclosed
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