SCHEMBL22314641

SCHEMBL22314641

O=C(O)c1c(I)c(NI)c(I)c(C(=O)O)c1I

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.41
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TPMT P51580 1/20 0.31

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
SCHEMBL4587818 0.81 TPMT (0.41) LMNATSHRMAPK1SMN1; SMN2TPMT
SCHEMBL9009368 0.78 LMNA (0.43) LMNATSHRMAPK1SMN1; SMN2TPMT
Hydrochloric Acid SCHEMBL9787611 0.78 TPMT (0.39) LMNATSHRMAPK1TPMT
Hydrochloric Acid SCHEMBL4589564 0.76 LMNA (0.42) LMNATSHRMAPK1SMN1; SMN2
SCHEMBL8537633 0.75 TPMT (0.38) LMNATSHRMAPK1TPMT
SCHEMBL8752140 0.75 LMNA (0.67) LMNATSHRMAPK1SMN1; SMN2
SCHEMBL7596897 0.74 TPMT (0.41) LMNATSHRMAPK1SMN1; SMN2TPMT
Hydrochloric Acid SCHEMBL8089018 0.73 LMNA (0.65) LMNATSHRMAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL8536294 0.73 TPMT (0.36) LMNATSHRMAPK1TPMT
SCHEMBL9600105 0.72 TPMT (0.39) LMNATSHRMAPK1TPMT

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-20200247939-A1 RADIOPAQUE THERMOPLASTIC POLYMER THE TEXAS A&M UNIVERSITY SYSTEM 2020-08-06 — — US disclosed
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