SCHEMBL6247495

SCHEMBL6247495

Nc1c(I)cc(I)c(CC(=O)O)c1I

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.55
CYP2C9 P11712 3/20 0.55
HIF1A Q16665 3/20 0.55
CYP1A2 P05177 3/20 0.55
ADRA1A P35348 2/20 0.55
CHRM1 P11229 1/20 0.55
TBXA2R P21731 1/20 0.55
PDE4A P27815 1/20 0.55
GABRB2 P47870 4/20 0.38
GABRA5 P31644 3/20 0.38
HSD17B10 Q99714 3/20 0.38
TDP1 Q9NUW8 2/20 0.35
AKR1B1 P15121 2/20 0.34
GABRA1 P14867 3/20 0.33
GABRA2 P47869 3/20 0.33
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33

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
SCHEMBL9696076 0.81 LMNA (0.53) LMNACYP2C9HIF1ACYP1A2ADRA1A
SCHEMBL8095483 0.79 CYP1A2 (0.50) LMNACYP2C9HIF1ACYP1A2ADRA1A
SCHEMBL8087407 0.78 LMNA (0.49) LMNACYP2C9HIF1ACYP1A2ADRA1A
SCHEMBL8095732 0.76 LMNA (0.48) LMNACYP2C9HIF1ACYP1A2ADRA1A
SCHEMBL9694437 0.76 LMNA (0.48) LMNACYP2C9HIF1ACYP1A2ADRA1A
SCHEMBL9695548 0.76 LMNA (0.48) LMNACYP2C9HIF1ACYP1A2ADRA1A
SCHEMBL4522860 0.76 LMNA (0.48) LMNACYP2C9HIF1ACYP1A2ADRA1A
SCHEMBL9002219 0.75 LMNA (0.66) LMNACYP2C9HIF1ACYP1A2ADRA1A
SCHEMBL9002211 0.75 LMNA (0.66) LMNACYP2C9HIF1ACYP1A2ADRA1A
SCHEMBL10001207 0.73 LMNA (0.66) LMNACYP2C9HIF1ACYP1A2ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871431-B1 HEPATOCYTE-SELECTIVE OIL-IN-WATER EMULSION UNIV MICHIGAN (US) 2005-07-20 EP disclosed
US-6126946-A Hepatocyte-selective oil-in-water emulsion UNIVERSITY OF MICHIGAN, THE BOARD OF REGENTS (US) 2000-10-03 US disclosed
US-6103216-A POLYHALOGENATED TRIGLYCERIDES, SUCH AS 2-OLEOYLGLYCEROL-1,3-BIS(7-(3-AMINO-2,4,6-TRIIODOPHENYL)HEPTAN OATE) OR 2-OLEOYLGLYCEROL-1,3-BIS(.OMEGA.-(3,5-BIS-TRIFLUOROMETHYL)-HEP THE BOARD OF REGENTS ACTING FOR AND ON BEHALF OF THE UNIVERSITY OF MICHIGAN (US) 2000-08-15 US disclosed
US-5985941-A BLENDS, HOMOGENIZING TO FORM EMULSIONS UNIVERSITY OF MICHIGAN (US) 1999-11-16 US disclosed
US-5851510-A Hepatocyte-selective oil-in-water emulsion THE BOARD OF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1998-12-22 US disclosed
EP-0871431-A2 HEPATOCYTE-SELECTIVE OIL-IN-WATER EMULSION THE BOARD OF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1998-10-21 EP disclosed
WO-1995031181-A1 HEPATOCYTE-SELECTIVE OIL-IN-WATER EMULSION THE BOARD OF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1995-11-23 WO disclosed
US-5093042-A Site-specific for liver; diagnosis of metastatic cancer THE UNIVERSITY OF MICHIGAN (US) 1992-03-03 US disclosed
US-4957729-A CONTRAST THE UNIVERSITY OF MICHIGAN (US) 1990-09-18 US disclosed
US-4873075-A SITE-SPECIFIC TO LIVER AND HEPATOCYTE; SCINTIGRAPHY IMAGING THE UNIVERSITY OF MICHIGAN (US) 1989-10-10 US disclosed