SCHEMBL8893753

SCHEMBL8893753

CNC(=O)NS(=O)(=O)c1cc(CC(=O)NC(C)c2ccoc2)ccc1OC

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.39
THRB P10828 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 3/20 0.38
TSHR P16473 1/20 0.38
CNR1 P21554 1/20 0.38
ABCC9 O60706 1/20 0.37
ABCC8 Q09428 1/20 0.37
KCNJ11 Q14654 1/20 0.37
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL8890978 0.91 ABCC9 (0.47) POLBL3MBTL1THRBALDH1A1KMT2A
SCHEMBL8891432 0.91 ALDH1A1 (0.37) POLBALDH1A1KMT2ACNR1GAA
SCHEMBL8892270 0.89 KEAP1 (0.39) POLBL3MBTL1ALDH1A1KMT2AGAA
SCHEMBL8890086 0.89 POLB (0.39) POLBL3MBTL1THRBALDH1A1KMT2A
SCHEMBL8891690 0.88 HTT (0.37) ALDH1A1KMT2ACNR1MEN1HTT
SCHEMBL8891142 0.85 HTT (0.35) L3MBTL1ALDH1A1KMT2ACNR1MEN1
SCHEMBL8898777 0.84 ALDH1A1 (0.41) POLBL3MBTL1ALDH1A1TSHRABCC9
SCHEMBL8891705 0.84 ALDH1A1 (0.39) POLBL3MBTL1ALDH1A1KMT2ATSHR
SCHEMBL8890408 0.83 ALDH1A1 (0.39) POLBL3MBTL1THRBALDH1A1KMT2A
SCHEMBL8892844 0.82 ABCC9 (0.39) POLBALDH1A1KMT2ACNR1ABCC9

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
US-5607976-A ANNTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed