SCHEMBL7986119

SCHEMBL7986119

NCC(=O)N(CCO)c1c(I)c(C(N)=O)c(I)c(C(=O)NCC(O)CO)c1I

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.58
CYP2C19 P33261 1/20 0.58
HIF1A Q16665 1/20 0.58
EGFR P00533 1/20 0.31
SRC P12931 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
SCHEMBL7201113 0.96 LMNA (0.61) LMNACYP2C19HIF1AEGFRSRC
SCHEMBL7795950 0.92 LMNA (0.59) LMNACYP2C19HIF1AEGFRSRC
SCHEMBL7986036 0.90 LMNA (0.57) LMNACYP2C19HIF1AEGFRSRC
SCHEMBL9236621 0.87 LMNA (0.59) LMNACYP2C19HIF1AEGFRSRC
SCHEMBL9756265 0.87 LMNA (0.56) LMNACYP2C19HIF1AEGFRSRC
Ioversol SCHEMBL24711 0.87 LMNA (0.64) LMNACYP2C19HIF1AEGFRSRC
Ioversol SCHEMBL9745016 0.87 LMNA (0.64) LMNACYP2C19HIF1AEGFRSRC
SCHEMBL8438095 0.87 LMNA (0.64) LMNACYP2C19HIF1AEGFRSRC
SCHEMBL9009203 0.86 CYP2C19 (0.73) LMNACYP2C19HIF1AEGFRSRC
SCHEMBL5033214 0.85 LMNA (0.61) LMNACYP2C19HIF1AEGFRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0839056-A4 PROCESS FOR PRODUCING IOVERSOL MALLINCKRODT MEDICAL INC (US) 2000-09-13 EP disclosed
EP-0886634-A4 PROCESS FOR PRODUCING IOVERSOL MALLINCKRODT MEDICAL INC (US) 2000-08-02 EP disclosed
EP-0886634-A1 PROCESS FOR PRODUCING IOVERSOL MALLINCKRODT MEDICAL, INC. (US) 1998-12-30 EP disclosed
EP-0839056-A1 PROCESS FOR PRODUCING IOVERSOL MALLINCKRODT MEDICAL, INC. (US) 1998-05-06 EP disclosed
WO-1997027172-A1 PROCESS FOR PRODUCING IOVERSOL MALLINCKRODT MEDICAL, INC. (US) 1997-07-31 WO disclosed
WO-1996040286-A1 PROCESS FOR PRODUCING IOVERSOL MALLINCKRODT MEDICAL, INC. (US) 1996-12-19 WO disclosed
EP-0628024-A4 SYNTHESIS OF IOVERSOL USING A MINIMAL EXCESS OF ACETOXYACETYLCHLORIDE. MALLINCKRODT MEDICAL INC (US) 1995-03-22 EP disclosed
EP-0628024-A1 SYNTHESIS OF IOVERSOL USING A MINIMAL EXCESS OF ACETOXYACETYLCHLORIDE MALLINCKRODT MEDICAL, INC. (US) 1994-12-14 EP disclosed
EP-0598751-A1 SYNTHESIS OF IOVERSOL USING CHLOROACETYL CHLORIDE MALLINCKRODT MEDICAL, INC. (US) 1994-06-01 EP disclosed
WO-1993016981-A1 SYNTHESIS OF IOVERSOL USING A MINIMAL EXCESS OF ACETOXYACETYLCHLORIDE MALLINCKRODT MEDICAL, INC. (US) 1993-09-02 WO disclosed
WO-1993001840-A1 SYNTHESIS OF IOVERSOL USING CHLOROACETYL CHLORIDE MALLINCKRODT MEDICAL, INC. (US) 1993-02-04 WO disclosed
EP-0083964-A1 Compounds suitable for X-ray visualisation methods Mallinckrodt, Inc. (a Delaware corporation) (US) 1983-07-20 EP disclosed