Iodide

Iodide

SCHEMBL5221809

C[n+]1ccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(Cl)cc2)cc1.[I-]

nearest known ligand 0.64

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
APOBEC3A P31941 3/20 0.64
APOBEC3G Q9HC16 3/20 0.64
CTDSP1 Q9GZU7 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
F10 P00742 6/20 0.58
PABPC1 P11940 1/20 0.54
EIF4H Q15056 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
MAPT P10636 1/20 0.53
POLB P06746 2/20 0.52
SMO Q99835 1/20 0.50
CA2 P00918 1/20 0.50
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
NR1H4 Q96RI1 1/20 0.49
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48

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
SCHEMBL12316777 0.85 POLB (0.69) F10RXFP1MAPTPOLBSMO
SCHEMBL5226687 0.81 NPC1 (0.74) L3MBTL1F10RXFP1PPARGPPARA
SCHEMBL5223022 0.81 POLB (0.75) F10RXFP1POLBNPC1RAB9A
Bromide SCHEMBL5228524 0.80 PKM (0.57) F10RXFP1MAPTPOLBSMO
SCHEMBL24073684 0.78 SMN1; SMN2 (0.74) F10RXFP1POLBSMONPC1
SCHEMBL30142707 0.78 SMN1; SMN2 (0.74) F10RXFP1POLBSMONPC1
SCHEMBL10179708 0.78 F10 (0.79) F10RXFP1
SCHEMBL11923494 0.76 APOBEC3A (0.66) APOBEC3AAPOBEC3GCTDSP1L3MBTL1PABPC1
SCHEMBL18499236 0.76 APOBEC3A (1.00) APOBEC3AAPOBEC3GCTDSP1L3MBTL1PABPC1
SCHEMBL10178347 0.75 F10 (0.69) F10RXFP1CA2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1014962-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2007-06-27 EP disclosed
US-6605626-B2 Benzamide inhibitors of factor Xa ELI LILLY AND COMPANY 2003-08-12 US disclosed
US-20020120007-A1 Benzamide inhibitors of factor Xa BEIGHT DOUGLAS WADE (US) 2002-08-29 US disclosed
US-6313122-B1 AS INHIBITORS OF FACTOR XA AND ARE USED AS ANTICOAGULANTS IN MAMMALS ELI LILLY AND COMPANY 2001-11-06 US disclosed
EP-1014962-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-05 EP disclosed
WO-1999000121-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020120007-A1 Benzamide inhibitors of factor Xa TFPI, F11, F12 APOBEC3A 2248/4885APOBEC3G 2089/4885CTDSP1 2115/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.