SCHEMBL29088010

SCHEMBL29088010

COCC(=O)Nc1c(I)c(C(=O)Cl)c(I)c(C(=O)N(C)CC(O)CO)c1I

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.76
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
TYMP P19971 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
SCHEMBL12885826 0.94 LMNA (0.84) LMNACYP2C19HIF1AMAPTHPGD
SCHEMBL8859007 0.90 LMNA (0.77) LMNACYP2C19HIF1AMAPTHPGD
SCHEMBL709499 0.89 LMNA (0.64) LMNACYP2C19HIF1AHPGD
SCHEMBL9009265 0.86 LMNA (0.58) LMNACYP2C19HIF1A
Iopromide SCHEMBL29632300 0.86 LMNA (1.00) LMNACYP2C19HIF1AMAPTHPGD
Iopromide SCHEMBL24546 0.86 LMNA (1.00) LMNACYP2C19HIF1AMAPTHPGD
Iopromide SCHEMBL8845234 0.86 LMNA (1.00) LMNACYP2C19HIF1AMAPTHPGD
SCHEMBL13309814 0.85 LMNA (0.90) LMNACYP2C19HIF1AHPGD
SCHEMBL18931642 0.84 LMNA (0.91) LMNACYP2C19HIF1A
SCHEMBL14864477 0.84 LMNA (0.91) LMNACYP2C19HIF1A

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
CN-116891420-A Synthesis method of iopromide impurity D 重庆圣华曦药业股份有限公司 2023-10-17 CN claimed
CN-116891420-A Synthesis method of iopromide impurity D 重庆圣华曦药业股份有限公司 2023-10-17 CN disclosed
CN-116891420-A Synthesis method of iopromide impurity D 重庆圣华曦药业股份有限公司 2023-10-17 CN disclosed