SCHEMBL8397974

SCHEMBL8397974

CCN(CC)CCN(C=O)CCN(CC)CC

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PAOX Q6QHF9 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL9218609 0.92 TSHR (0.32) TSHRMEN1POLBKMT2ASMN1; SMN2
SCHEMBL10552009 0.79
SCHEMBL3940066 0.78 ALDH1A1 (0.35) TSHRMEN1POLBKMT2APAOX
SCHEMBL16317707 0.77 ADH1A (0.39) TSHRSMN1; SMN2ALDH1A1
SCHEMBL1307259 0.76 USP2 (0.36) TSHRMEN1POLBKMT2APAOX
SCHEMBL232247 0.74 MEN1 (0.39) TSHRMEN1POLBKMT2APAOX
SCHEMBL15052708 0.74 MEN1 (0.39) TSHRMEN1POLBKMT2APAOX
SCHEMBL2916 0.73
SCHEMBL6991188 0.72 TSHR (0.33) TSHRMEN1POLBKMT2A
SCHEMBL26744523 0.72 ALDH1A1 (0.35) TSHRMEN1POLBKMT2APAOX

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7485633-B2 RNA polymerase, HCV metalloprotease, HCV serine protease, HCV polymerase, HCV helicase inhibitor; liver disease; (+/-)-8-Cyclohexyl-N-4-(morpholinosulfonyl)-1,1a,2,12b-tetrahydro-11-methoxy-1a-(3-methyl-3,8-diazabicyclo[3.2.1]octane-8-carbonyl)cycloprop[d]indolo[2,1-a][2]benzazepine-5-carboxamide BRISTOL-MYERS SQUIBB COMPANY (US) 2009-02-03 US disclosed
US-5973094-A Functional polymers WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-26 US disclosed
EP-0794199-A2 Novel functional polymers WAKO PURE CHEMICAL INDUSTRIES, LTD (JP) 1997-09-10 EP disclosed