SCHEMBL21164396

SCHEMBL21164396

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

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.78
HIF1A Q16665 1/20 0.78
LMNA P02545 2/20 0.74
EGFR P00533 1/20 0.34
SRC P12931 1/20 0.34
MAP2K1 Q02750 5/20 0.31
MAP2K2 P36507 1/20 0.30
PRKCZ Q05513 1/20 0.30
IARS2 Q9NSE4 1/20 0.30
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
TAS1R2 Q8TE23 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
SCHEMBL20034186 0.95 LMNA (0.82) CYP2C19HIF1ALMNAEGFRSRC
SCHEMBL14601670 0.95 CYP2C19 (0.86) CYP2C19HIF1ALMNAEGFRSRC
SCHEMBL19915482 0.95 CYP2C19 (0.86) CYP2C19HIF1ALMNAEGFRSRC
SCHEMBL20350848 0.93 LMNA (0.86) CYP2C19HIF1ALMNAEGFRSRC
SCHEMBL10329899 0.92 LMNA (0.88) CYP2C19HIF1ALMNAEGFRSRC
SCHEMBL20829072 0.89 LMNA (0.76) CYP2C19HIF1ALMNAEGFRSRC
SCHEMBL24114250 0.88 CYP2C19 (0.66) CYP2C19HIF1ALMNAEGFRSRC
SCHEMBL24169901 0.88 LMNA (0.73) CYP2C19HIF1ALMNAEGFRSRC
Iohexol SCHEMBL37920 0.88 CYP2C19 (1.00) CYP2C19HIF1ALMNAEGFRSRC
Iohexol SCHEMBL26501 0.88 CYP2C19 (1.00) CYP2C19HIF1ALMNAEGFRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11911041-B2 Embolic compositions MICROVENTION, INC. (US) 2024-02-27 US disclosed
US-20210330334-A1 EMBOLIC COMPOSITIONS MICROVENTION, INC. 2021-10-28 US disclosed
US-11051826-B2 Embolic compositions MICROVENTION, INC. (US) 2021-07-06 US disclosed
US-20190298388-A1 EMBOLIC COMPOSITIONS MICROVENTION, INC. 2019-10-03 US disclosed
US-10350311-B2 Iohexol powder and method of using the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-07-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10350311-B2 Iohexol powder and method of using the same PPIP5K2, SLC5A11, IP6K2 CYP2C19 545/4885HIF1A 2076/4885LMNA 3959/4885
US-11911041-B2 Embolic compositions PLG, FGB, TNNC1 CYP2C19 3137/4885HIF1A 225/4885LMNA 182/4885
US-20210330334-A1 EMBOLIC COMPOSITIONS PLG, FGB, TNNC1 CYP2C19 3137/4885HIF1A 225/4885LMNA 182/4885
US-20190298388-A1 EMBOLIC COMPOSITIONS PLG, FGB, TNNC1 CYP2C19 3137/4885HIF1A 225/4885LMNA 182/4885
US-11051826-B2 Embolic compositions PLG, FGB, TNNC1 CYP2C19 3137/4885HIF1A 225/4885LMNA 182/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.