SCHEMBL8380649

SCHEMBL8380649

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

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
LMNA P02545 2/20 0.39

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
SCHEMBL9189582 0.96 CYP2C19 (0.40) CYP2C19HIF1ALMNA
SCHEMBL9196450 0.93 CYP2C19 (0.42) CYP2C19HIF1ALMNA
SCHEMBL9736246 0.93 CYP2C19 (0.45) CYP2C19HIF1ALMNA
SCHEMBL9548440 0.92 CYP2C19 (0.40) CYP2C19HIF1ALMNA
SCHEMBL5030981 0.91 CYP2C19 (0.40) CYP2C19HIF1ALMNA
SCHEMBL9581171 0.88 CYP2C19 (0.42) CYP2C19HIF1ALMNA
SCHEMBL9194273 0.84 CYP2C19 (0.51) CYP2C19HIF1ALMNA
SCHEMBL9735199 0.84 CYP2C19 (0.42) CYP2C19HIF1ALMNA
SCHEMBL30358365 0.84 LMNA (0.31) CYP2C19HIF1ALMNA
SCHEMBL7095050 0.84 CYP2C19 (0.39) CYP2C19HIF1ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0907395-A1 REVERSED PHASE CHROMATOGRAPHIC PROCESS Mallinckrodt Medical Imaging-Ireland (IE) 1999-04-14 EP claimed
EP-0863782-A1 REVERSED PHASE CHROMATOGRAPHIC PROCESS Mallinckrodt Medical Imaging-Ireland (IE) 1998-09-16 EP claimed
WO-1997046299-A1 REVERSED PHASE CHROMATOGRAPHIC PROCESS MALLINCKRODT MEDICAL IMAGING-IRELAND (IE) 1997-12-11 WO claimed
WO-1997020609-A1 REVERSED PHASE CHROMATOGRAPHIC PROCESS MALLINCKRODT MEDICAL IMAGING-IRELAND (IE) 1997-06-12 WO claimed
EP-0618836-A4 PURIFICATION OF CRUDE IOVERSOL USING REVERSE OSMOSIS. MALLINCKRODT MEDICAL INC (US) 1995-01-04 EP claimed
EP-0618836-A1 PURIFICATION OF CRUDE IOVERSOL USING REVERSE OSMOSIS MALLINCKRODT MEDICAL, INC. (US) 1994-10-12 EP claimed
WO-1993010887-A1 PURIFICATION OF CRUDE IOVERSOL USING REVERSE OSMOSIS MALLINCKRODT MEDICAL, INC. (US) 1993-06-10 WO claimed
EP-0598751-B1 SYNTHESIS OF IOVERSOL USING CHLOROACETYL CHLORIDE MALLINCKRODT MEDICAL INC (US) 1999-03-24 EP disclosed
EP-0470247-B1 REVERSED PHASE CHROMATOGRAPHIC PROCESS MALLINCKRODT INC (US) 1997-04-16 EP disclosed
EP-0628024-A4 SYNTHESIS OF IOVERSOL USING A MINIMAL EXCESS OF ACETOXYACETYLCHLORIDE. MALLINCKRODT MEDICAL INC (US) 1995-03-22 EP disclosed
EP-0598751-A4 SYNTHESIS OF IOVERSOL USING CHLOROACETYL CHLORIDE. MALLINCKRODT MEDICAL INC (US) 1995-01-18 EP disclosed
EP-0628024-A1 SYNTHESIS OF IOVERSOL USING A MINIMAL EXCESS OF ACETOXYACETYLCHLORIDE MALLINCKRODT MEDICAL, INC. (US) 1994-12-14 EP disclosed
US-5371278-A Increasing reaction solution concentration and temperature MALLINCKRODT MEDICAL PMC (US) 1994-12-06 US disclosed
US-5210300-A PURIFICATION OF CRUDE IOVERSOL USING CONTINUOUS DEIONIZATION MALINCKRODT MEDICAL, INC. (US) 1993-05-11 US disclosed
WO-1993001840-A1 SYNTHESIS OF IOVERSOL USING CHLOROACETYL CHLORIDE MALLINCKRODT MEDICAL, INC. (US) 1993-02-04 WO disclosed
US-5177261-A SYNTHESIS OF IOVERSOL USING CHLOROACETYL CHLORIDE MALLINCKRODT MEDICAL, INC. (US) 1993-01-05 US disclosed
EP-0365541-B1 PREPARATION OF 5-ACYLAMINO-2,4,6-TRIIODO- OR TRIBROMO-BENZOIC ACID DERIVATIVES BRACCO S.p.A. (IT) 1992-08-12 EP disclosed
US-5066823-A Rearrangement reaction, contrast agent for radiology BRACCO INDUSTRIA CHEMICA S.P.A. (IT) 1991-11-19 US disclosed
EP-0365541-A1 PREPARATION OF 5-ACYLAMINO-2,4,6-TRIIODO- OR TRIBROMO-BENZOIC ACID DERIVATIVES. BRACCO IND CHIMICA SPA (IT) 1990-05-02 EP disclosed
WO-1988009328-A1 PREPARATION OF 5-ACYLAMINO-2,4,6-TRIIODO- OR TRIBROMO-BENZOIC ACID DERIVATIVES BRACCO INDUSTRIA CHIMICA S.P.A. (IT) 1988-12-01 WO disclosed