SCHEMBL23961990

SCHEMBL23961990

CCCC(C)N1Cc2ccccc2-c2nnn(CC)c2-c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.33
TOP2A P11388 1/20 0.32
IDO1 P14902 3/20 0.31
TDO2 P48775 3/20 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
SCHEMBL24252205 0.90 LMNA (0.31)
SCHEMBL23961924 0.89 SLC9A1 (0.39) SLC9A1TOP2A
SCHEMBL23962156 0.89 MAP3K5 (0.33) TOP2A
SCHEMBL22643744 0.89 SLC9A1 (0.35) SLC9A1TOP2AIDO1TDO2
SCHEMBL24115412 0.88 MAP3K5 (0.33)
SCHEMBL23604940 0.87 MAP3K5 (0.32)
SCHEMBL24974789 0.86 SLC9A1 (0.34) SLC9A1TOP2AIDO1TDO2
SCHEMBL23961890 0.85
SCHEMBL22210697 0.84 SLC9A1 (0.35) SLC9A1TOP2AIDO1TDO2
SCHEMBL21152761 0.83 MAP3K5 (0.33)

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-20210332080-A1 HYDROPHILIC LINKERS FOR ANTIBODY DRUG CONJUGATES REGENERON PHARMACEUTICALS, INC. 2021-10-28 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-20210332080-A1 HYDROPHILIC LINKERS FOR ANTIBODY DRUG CONJUGATES CD44, CD47, EPCAM SLC9A1 1849/4885TOP2A 594/4885IDO1 4286/4885

“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.