SCHEMBL8256875

SCHEMBL8256875

CCC(C)C1NC(=O)C(CCC(=O)O)NC(=O)C(CO)NC(=O)CNC(=O)C(CC(=O)O)NC(=O)C(CC(N)=O)NC(=O)C(CC(=O)O)NC(=O)C(CCCN)NC(=O)CNC(=O)C(NC(=O)C(CC(=O)O)NC(=O)C(CC(N)=O)NC(=O)C(Cc2c[nH]c3ccccc23)NC=O)C(C)OC1=O

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.68
▸ DRD1 P21728 1/20 0.68
▸ PTGS1 P23219 1/20 0.68
▸ PDE4A P27815 1/20 0.68
▸ OXTR P30559 2/20 0.42
▸ NECTIN4 Q96NY8 9/20 0.41
▸ KEAP1 Q14145 2/20 0.41
▸ FLT1 P17948 1/20 0.39
▸ TSLP Q969D9 1/20 0.39
▸ SSTR1 P30872 2/20 0.39
▸ SSTR2 P30874 2/20 0.39
▸ SSTR4 P31391 2/20 0.39
▸ SSTR3 P32745 2/20 0.39
▸ SSTR5 P35346 2/20 0.39
▸ F2 P00734 1/20 0.39

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
SCHEMBL8259387 0.95 CTSL (0.70) CTSLDRD1PTGS1PDE4AOXTR
SCHEMBL14301057 0.94 CTSL (0.67) CTSLDRD1PTGS1PDE4AOXTR
SCHEMBL14305575 0.93 CTSL (0.64) CTSLDRD1PTGS1PDE4AOXTR
SCHEMBL8252755 0.93 CTSL (0.71) CTSLDRD1PTGS1PDE4AOXTR
SCHEMBL14301032 0.93 CTSL (0.63) CTSLDRD1PTGS1PDE4AOXTR
SCHEMBL8260309 0.93 CTSL (0.73) CTSLDRD1PTGS1PDE4AOXTR
SCHEMBL14300849 0.92 CTSL (0.77) CTSLDRD1PTGS1PDE4AOXTR
SCHEMBL8258073 0.92 CTSL (0.72) CTSLDRD1PTGS1PDE4AOXTR
SCHEMBL14274728 0.92 CTSL (0.74) CTSLDRD1PTGS1PDE4AOXTR
SCHEMBL14177523 0.92 CTSL (0.72) CTSLDRD1PTGS1PDE4AOXTR

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-2006110185-A2 ANTIINFECTIVE LIPOPEPTIDES CUBIST PHARMACEUTICALS, INC. (US) 2006-10-19 — — WO disclosed
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