SCHEMBL7986005

SCHEMBL7986005

CC(=O)OCC(CNC(=O)c1c(I)cc(I)c(C(N)=O)c1I)OC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.39
LMNA P02545 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32
AR P10275 1/20 0.32
SERPINE1 P05121 1/20 0.31
GAA P10253 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
SCHEMBL5484159 0.94 ABCB1 (0.42) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL28880448 0.86 LMNA (0.36) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL11387672 0.85 ABCB1 (0.38) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL8338637 0.84 ABCB1 (0.30) ABCB1POLBMAPK1
SCHEMBL9009211 0.84 ABCB1 (0.38) ABCB1TDP1POLBMAPK1AR
SCHEMBL7986029 0.84 LMNA (0.35) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL8905997 0.83 LMNA (0.38) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL8377994 0.82 LMNA (0.38) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL1359798 0.82 LMNA (0.38) ABCB1LMNACYP2C19HIF1ATDP1
SCHEMBL28880451 0.80 LMNA (0.43) ABCB1LMNACYP2C19HIF1A

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0700377-B1 PURIFICATION OF 1,1,2-TRICHLOROETHANE MALLINCKRODT MEDICAL INC (US) 1999-03-31 EP claimed
EP-0598751-B1 SYNTHESIS OF IOVERSOL USING CHLOROACETYL CHLORIDE MALLINCKRODT MEDICAL INC (US) 1999-03-24 EP claimed
EP-0640067-B1 IMPROVED SYNTHESIS OF IOVERSOL MALLINCKRODT MEDICAL INC (US) 1997-03-12 EP claimed
EP-0640067-A4 IMPROVED SYNTHESIS OF IOVERSOL. MALLINCKRODT MEDICAL INC (US) 1995-05-31 EP claimed
EP-0640067-A1 IMPROVED SYNTHESIS OF IOVERSOL. MALLINCKRODT MEDICAL INC (US) 1995-03-01 EP claimed
WO-1993023365-A1 IMPROVED SYNTHESIS OF IOVERSOL MALLINCKRODT MEDICAL, INC. (US) 1993-11-25 WO claimed
EP-0513063-A1 PROCESS FOR PRODUCTION OF IOVERSOL. MALLINCKRODT INC (US) 1992-11-19 EP claimed
US-4997983-A Process for production of ioversol MALLINCKRODT, INC. (US) 1991-03-05 US claimed
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-0700377-B1 PURIFICATION OF 1,1,2-TRICHLOROETHANE MALLINCKRODT MEDICAL INC (US) 1999-03-31 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
EP-0513063-B1 PROCESS FOR PRODUCTION OF IOVERSOL MALLINCKRODT INC (US) 1995-05-17 EP disclosed
WO-1994027956-A1 PURIFICATION OF 1,1,2-TRICHLOROETHANE MALLINCKRODT MEDICAL, INC. (US) 1994-12-08 WO disclosed
EP-0516050-A2 Methods and compositions for using non-ionic contrast agents to reduce the risk of clot formation in diagnostic procedures BRACCO INTERNATIONAL B.V. (NL) 1992-12-02 EP disclosed
EP-0513063-A1 PROCESS FOR PRODUCTION OF IOVERSOL. MALLINCKRODT INC (US) 1992-11-19 EP disclosed
WO-1991011431-A1 PROCESS FOR PRODUCTION OF IOVERSOL MALLINCKRODT, INC. (US) 1991-08-08 WO disclosed
US-4997983-A Process for production of ioversol MALLINCKRODT, INC. (US) 1991-03-05 US disclosed