SCHEMBL14264014

SCHEMBL14264014

CC(=O)c1cc(I)c(NC(=O)c2cc(C)c(I)c(I)c2)c(I)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KMT2A Q03164 8/20 0.37
▸ MEN1 O00255 7/20 0.37
▸ MAPK1 P28482 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ TPMT P51580 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ GAA P10253 4/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ POLB P06746 3/20 0.33
▸ HTT P42858 2/20 0.33
▸ FKBP5 Q13451 1/20 0.33
▸ PTGER4 P35408 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ HPGD P15428 1/20 0.33

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
SCHEMBL14264013 0.90 TPMT (0.44) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL16769478 0.75 CA5A (0.48) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL14275457 0.75 TPMT (0.67) NPC1KMT2AMEN1MAPK1L3MBTL1
SCHEMBL14264012 0.73 TPMT (0.61) RAB9ANPC1SMN1; SMN2KMT2AL3MBTL1
SCHEMBL23817375 0.70 TPMT (0.71) SMN1; SMN2KMT2AMEN1MAPK1TPMT
SCHEMBL18629882 0.70 CA5A (0.48) KMT2AMEN1TPMTMAPTLMNA
SCHEMBL14264003 0.68 TPMT (0.38) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL14277282 0.67 CA5A (0.48) RAB9ANPC1SMN1; SMN2KMT2AMAPK1
SCHEMBL96185 0.67 CA5A (0.52) RAB9ANPC1SMN1; SMN2KMT2AL3MBTL1
SCHEMBL15262165 0.66 HDAC8 (0.43) SMN1; SMN2LMNAALDH1A1HTTHPGD

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-20080064848-A1 Radiopaque amide polymers and medical devices formed thereof BOSTON SCIENTIFIC SCIMED, INC. (US) 2008-03-13 — — US disclosed
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