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SCHEMBL1760442

SCHEMBL1760442

CC(=O)N(CC(O)CN(C(C)=O)c1c(I)c(C(=O)N(O)CCCO)c(I)c(C(=O)N(O)CCCO)c1I)c1c(I)c(C(=O)NCC(O)CO)c(I)c(C(=O)NCC(O)CO)c1I

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.76
▸ CYP2C19 P33261 1/20 0.72
▸ HIF1A Q16665 1/20 0.72
▸ EGFR P00533 1/20 0.30
▸ SRC P12931 1/20 0.30

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
SCHEMBL1360544 0.90 LMNA (0.61) LMNACYP2C19HIF1A
SCHEMBL4191913 0.89 LMNA (0.60) LMNACYP2C19HIF1AEGFRSRC
SCHEMBL1360603 0.89 LMNA (0.60) LMNACYP2C19HIF1A
SCHEMBL1360996 0.89 LMNA (0.60) LMNACYP2C19HIF1A
SCHEMBL1360987 0.87 LMNA (0.58) LMNACYP2C19HIF1A
Iodixanol SCHEMBL8845042 0.87 LMNA (1.00) LMNACYP2C19HIF1AEGFRSRC
Iodixanol SCHEMBL37712 0.87 LMNA (1.00) LMNACYP2C19HIF1AEGFRSRC
Iodixanol SCHEMBL21546 0.87 LMNA (1.00) LMNACYP2C19HIF1AEGFRSRC
Iodixanol SCHEMBL22645199 0.86 LMNA (0.97) LMNACYP2C19HIF1AEGFRSRC
Iohexol SCHEMBL37920 0.85 CYP2C19 (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9278160-B2 Injectable void filler for soft tissue augmentation BAXTER INTERNATIONAL INC. (US) 2016-03-08 — — US disclosed
US-20130209370-A1 INJECTABLE VOID FILLER FOR SOFT TISSUE AUGMENTATION BAXTER INTERNATIONAL INC. (US) 2013-08-15 — — US disclosed
US-20110117027-A1 INJECTABLE VOID FILLER FOR SOFT TISSUE AUGMENTATION BAXTER HEALTHCARE S.A. (CH) 2011-05-19 — — US disclosed