SCHEMBL6666650

SCHEMBL6666650

CCCCCCCCCCCCCCCC(=O)NCC(=O)NC(Cc1cccc(N(CCCl)CCCl)c1)C(=O)NC(Cc1ccc(F)cc1)C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 3/20 0.40
▸ PSMB8 P28062 1/20 0.40
▸ PSEN1 P49768 1/20 0.40
▸ PSEN2 P49810 1/20 0.40
▸ APH1B Q8WW43 1/20 0.40
▸ NCSTN Q92542 1/20 0.40
▸ APH1A Q96BI3 1/20 0.40
▸ PSENEN Q9NZ42 1/20 0.40
▸ PTPN1 P18031 3/20 0.39
▸ CTSB P07858 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NOD2 Q9HC29 1/20 0.38
▸ FAAH O00519 2/20 0.38
▸ GRIA1 P42261 1/20 0.37
▸ KLKB1 P03952 1/20 0.37

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
SCHEMBL6667620 0.95 PSMB5 (0.44) PSMB5PSMB8PSEN1PSEN2APH1B
SCHEMBL10972441 0.81 LMNA (0.43) PSMB5PSMB8CTSBLMNASMN1; SMN2
SCHEMBL6838403 0.81 LMNA (0.47) PSMB5PSMB8LMNASMN1; SMN2
SCHEMBL10653540 0.81 LMNA (0.47) PSMB5PSMB8LMNASMN1; SMN2
SCHEMBL6843141 0.77 MC4R (0.43) PSMB5PSMB8PSEN1PSEN2APH1B
SCHEMBL6845514 0.77 MC4R (0.43) PSMB5PSMB8PSEN1PSEN2APH1B
Ambamustine SCHEMBL62822 0.76 LMNA (0.41) PTPN1LMNASMN1; SMN2
Ambamustine SCHEMBL1419557 0.76 LMNA (0.40) PTPN1LMNASMN1; SMN2
SCHEMBL11129156 0.76 HTT (0.39) PSMB5PSMB8PTPN1LMNASMN1; SMN2
SCHEMBL11122837 0.75 LMNA (0.42) CTSBLMNASMN1; SMN2

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-2004024755-A2 SARCOLYSYL DERIVATIVES AND METHOD FOR THE PRODUCTION THEREOF LIPAL BIOCHEMICALS AG (CH) 2004-03-25 — — WO disclosed
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