SCHEMBL22128273

SCHEMBL22128273

C[C@@H](CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)Cn1c(CO)cc2ccc(Br)cc21

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR9 P51686 1/20 0.33
OXER1 Q8TDS5 1/20 0.32
POLB P06746 1/20 0.31
CYP3A4 P08684 1/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
MAPK1 P28482 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
SCHEMBL22128275 1.00 CCR9 (0.33) CCR9OXER1POLBCYP3A4HTR2A
SCHEMBL22128243 0.85
SCHEMBL22128242 0.85
SCHEMBL22128169 0.84 CCR9 (0.33) CCR9HTR2AHTR2C
SCHEMBL22128170 0.84 CCR9 (0.33) CCR9HTR2AHTR2C
SCHEMBL22128370 0.78 AKR1B1 (0.32)
SCHEMBL22128371 0.78 AKR1B1 (0.32)
SCHEMBL22128218 0.77 B3GNT2 (0.40)
SCHEMBL22128221 0.77 B3GNT2 (0.40)
SCHEMBL28664000 0.74

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 2100/4885OXER1 4073/4885POLB 2323/4885
US-20200197391-A1 COMPOUNDS THAT PARTICIPATE IN COOPERATIVE BINDING AND USES THEREOF KRAS, NRAS, HRAS CCR9 2100/4885OXER1 4073/4885POLB 2323/4885

“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.