SCHEMBL22128170

SCHEMBL22128170

CC(CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)Cn1c(C=O)cc2ccc(Br)cc21

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR9 P51686 1/20 0.33
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
SMYD2 Q9NRG4 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
SCHEMBL22128169 1.00 CCR9 (0.33) CCR9HTR2AHTR2CSMYD2
SCHEMBL22128275 0.84 CCR9 (0.33) CCR9HTR2AHTR2C
SCHEMBL22128273 0.84 CCR9 (0.33) CCR9HTR2AHTR2C
SCHEMBL22128243 0.79
SCHEMBL22128242 0.79
SCHEMBL22128218 0.78 B3GNT2 (0.40)
SCHEMBL22128221 0.78 B3GNT2 (0.40)
SCHEMBL22128217 0.78 KMT2A (0.39)
SCHEMBL22128358 0.78
SCHEMBL22128220 0.78 KMT2A (0.39)

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-20240139185-A1 COMPOUNDS THAT PARTICIPATE IN COOPERATIVE BINDING AND USES THEREOF WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2024-05-02 US disclosed
CN-113498342-A Compounds involved in synergistic binding and uses thereof 锐新医药公司 2021-10-12 CN disclosed
US-20200197391-A1 COMPOUNDS THAT PARTICIPATE IN COOPERATIVE BINDING AND USES THEREOF Revolution Medicines, Inc. 2020-06-25 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 (2 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-20240139185-A1 COMPOUNDS THAT PARTICIPATE IN COOPERATIVE BINDING AND USES THEREOF KRAS, NRAS, HRAS CCR9 2100/4885HTR2A 4551/4885HTR2C 4606/4885
US-20200197391-A1 COMPOUNDS THAT PARTICIPATE IN COOPERATIVE BINDING AND USES THEREOF KRAS, NRAS, HRAS CCR9 2100/4885HTR2A 4551/4885HTR2C 4606/4885

“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.