SCHEMBL21705602

SCHEMBL21705602

C=CCOC(=O)N1CCN(CCOC(=O)c2cc(I)cc(I)c2I)CC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 4/20 0.42
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
SLC29A1 Q99808 1/20 0.36
CYP3A4 P08684 2/20 0.35
KMT2A Q03164 2/20 0.34
HPGD P15428 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HRH2 P25021 1/20 0.34
HRH1 P35367 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
SLC6A15 Q9H2J7 1/20 0.33
MEN1 O00255 1/20 0.33
GLA P06280 1/20 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
SCHEMBL21705218 0.86 ALDH1A1 (0.46) HTR4SLC29A1CYP3A4KMT2AHPGD
SCHEMBL21705210 0.83 HTR4 (0.42) HTR4SLC29A1
SCHEMBL21705612 0.82 CA1 (0.46) HTR4RAB9AKMT2AHRH2HRH1
SCHEMBL21783772 0.81 HRH3 (0.49) HTR4SLC29A1CYP3A4KMT2AHPGD
SCHEMBL21705754 0.81 KMT2A (0.50) HTR4SLC29A1CYP3A4KMT2AHPGD
SCHEMBL21705757 0.80 HTR4 (0.43) HTR4LMNASLC29A1CYP3A4KMT2A
SCHEMBL21705213 0.80 KMT2A (0.52) HTR4CYP3A4KMT2AHPGDKDM4E
SCHEMBL21705199 0.78 ATM (0.52) LMNAKMT2AHPGDKDM4EALDH1A1
SCHEMBL21783770 0.78 HPGD (0.41) HTR4SLC29A1CYP3A4KMT2AHPGD
SCHEMBL21783771 0.78 KMT2A (0.39) HTR4LMNASLC29A1CYP3A4KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200050105-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-02-13 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 (1 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-20200050105-A1 RESIST COMPOSITION AND PATTERNING PROCESS HNRNPU, HNRNPR, ZFR HTR4 849/4885LMNA 1514/4885MAPK1 2950/4885

“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.