SCHEMBL28977699

SCHEMBL28977699

C=C(C(=O)O)C1N(C)C=CN1CCCCCCCCCCCCCCCC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.35
GBA1 P04062 1/20 0.33
THRB P10828 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
PGGT1B P53609 1/20 0.33
KDM4E B2RXH2 2/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
BCHE P06276 2/20 0.32
POLB P06746 1/20 0.32
FASN P49327 1/20 0.32
PPARG P37231 6/20 0.32
PPARD Q03181 6/20 0.32
PPARA Q07869 6/20 0.32
GPR84 Q9NQS5 5/20 0.32
HDAC11 Q96DB2 5/20 0.32
TSHR P16473 4/20 0.32
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL28977683 1.00 KCNH2 (0.35) KCNH2GBA1THRBFNTAFNTB
SCHEMBL28979090 0.84 KCNH2 (0.35) KCNH2POLBFASNPPARGPPARD
SCHEMBL28283889 0.84 KCNH2 (0.35) KCNH2POLBFASNPPARGPPARD
SCHEMBL28285376 0.84 KCNH2 (0.35) KCNH2POLBFASNPPARGPPARD
SCHEMBL28285379 0.84 KCNH2 (0.35) KCNH2POLBFASNPPARGPPARD
SCHEMBL28979314 0.84 KCNH2 (0.35) KCNH2POLBFASNPPARGPPARD
SCHEMBL28979316 0.82 ALDH1A1 (0.33) KCNH2POLBFASNPPARGPPARD
SCHEMBL28977674 0.79
SCHEMBL1917059 0.77 ALDH1A1 (0.34) POLBFASNALDH1A1MEN1KMT2A
SCHEMBL28303811 0.73 CDC25A (0.41) KCNH2BCHEPPARGPPARDPPARA

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
CN-115867586-A Electrochemically debondable adhesive compositions 汉高股份有限及两合公司 2023-03-28 CN disclosed