Iodide

Iodide

SCHEMBL30758596

COc1ccc(NC(=O)c2ccccc2)cc1.I

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG

The experimentally established mechanism targets of Iodide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.97
NPC1 O15118 10/20 0.97
SMN1; SMN2 Q16637 3/20 0.80
TP53 P04637 1/20 0.80
ALOX15 P16050 1/20 0.80
KCNK9 Q9NPC2 1/20 0.74
PGR P06401 2/20 0.71
HTT P42858 1/20 0.71
MEN1 O00255 2/20 0.70
KMT2A Q03164 2/20 0.70
PTGS2 P35354 1/20 0.69
CASP3 P42574 1/20 0.68
SENP7 Q9BQF6 1/20 0.68
NLRP3 Q96P20 1/20 0.67
ALDH1A1 P00352 2/20 0.65
LMNA P02545 1/20 0.65
MAPT P10636 1/20 0.65
KDM4E B2RXH2 1/20 0.65
CYP1A2 P05177 1/20 0.65
F10 P00742 1/20 0.65

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
SCHEMBL4963650 0.98 RAB9A (1.00) RAB9ANPC1SMN1; SMN2TP53ALOX15
Hydrochloric Acid SCHEMBL29693066 0.97 RAB9A (0.97) RAB9ANPC1SMN1; SMN2TP53ALOX15
Nitrogen SCHEMBL28090858 0.93 RAB9A (0.90) RAB9ANPC1SMN1; SMN2TP53ALOX15
SCHEMBL11548282 0.93 RAB9A (0.90) RAB9ANPC1SMN1; SMN2TP53ALOX15
SCHEMBL5340339 0.92 RAB9A (0.88) RAB9ANPC1SMN1; SMN2TP53ALOX15
SCHEMBL2919439 0.91 RAB9A (0.87) RAB9ANPC1SMN1; SMN2TP53ALOX15
SCHEMBL28185905 0.91 RAB9A (0.85) RAB9ANPC1SMN1; SMN2TP53ALOX15
SCHEMBL31179828 0.89 KCNK9 (0.83) RAB9ANPC1SMN1; SMN2TP53ALOX15
SCHEMBL6799157 0.89 RAB9A (1.00) RAB9ANPC1SMN1; SMN2TP53ALOX15
SCHEMBL12010917 0.89 RAB9A (0.82) RAB9ANPC1SMN1; SMN2TP53ALOX15

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
CN-117466799-A Preparation method of N-substituted phthalimide compound 西北师范大学 2024-01-30 CN claimed
CN-117466799-B N-substituted phthalic acid diamide preparation method of imine compound 西北师范大学 2024-12-24 CN disclosed
CN-117466799-A Preparation method of N-substituted phthalimide compound 西北师范大学 2024-01-30 CN disclosed