SCHEMBL22855045

SCHEMBL22855045

CCOCCOC(C)(C)CCC(=O)NCCNC(=S)Nc1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CA9 Q16790 15/20 0.61
▸ CA1 P00915 14/20 0.61
▸ CA2 P00918 14/20 0.61
▸ CA12 O43570 6/20 0.61
▸ CA14 Q9ULX7 2/20 0.59
▸ CA7 P43166 2/20 0.59
▸ FKBP1A P62942 2/20 0.56
▸ PTGER3 P43115 1/20 0.52
▸ BTK Q06187 1/20 0.51

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
SCHEMBL17245254 0.91 CA1 (0.64) CA9CA1CA2CA12CA14
SCHEMBL19455756 0.91 CA1 (0.64) CA9CA1CA2CA12CA14
SCHEMBL14754541 0.88 CA1 (0.67) CA9CA1CA2CA12CA14
SCHEMBL18737255 0.88 CA9 (0.67) CA9CA1CA2CA12CA14
SCHEMBL18737217 0.88 CA9 (0.65) CA9CA1CA2CA12CA14
SCHEMBL21183301 0.88 CA1 (0.70) CA9CA1CA2CA12CA14
SCHEMBL21282083 0.88 CA1 (0.70) CA9CA1CA2CA12CA14
SCHEMBL17245251 0.88 CA1 (0.70) CA9CA1CA2CA12CA14
SCHEMBL22203877 0.86 CA1 (0.66) CA9CA1CA2CA12CA14
SCHEMBL15958213 0.85 CA9 (0.70) CA9CA1CA2CA12CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11759480-B2 Compositions and methods for CAR T cell therapy ENDOCYTE, INC. (US) 2023-09-19 — — US disclosed
US-20210346431-A1 SEQUENCING METHOD FOR CAR T CELL THERAPY Seattle Children's Hospital (dba Seattle Children's Research Institute) 2021-11-11 — — US disclosed
US-20200405760-A1 COMPOSITIONS AND METHODS FOR CAR T CELL THERAPY ENDOCYTE, INC. 2020-12-31 — — US disclosed
US-20160326086-A1 4-HYDROXYBUTYRIC ACID ANALOGS SUN PHARMACEUTICAL INDUSTRIES, INC. 2016-11-10 — — 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 (4 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-11759480-B2 Compositions and methods for CAR T cell therapy CD47, PBK, GZMB CA9 542/4885CA1 1175/4885CA2 3139/4885
US-20160326086-A1 4-HYDROXYBUTYRIC ACID ANALOGS HCRTR2, HCRTR1, HTR2B CA9 1670/4885CA1 1490/4885CA2 351/4885
US-20210346431-A1 SEQUENCING METHOD FOR CAR T CELL THERAPY CD47, MCTS1, GZMB CA9 567/4885CA1 2463/4885CA2 3547/4885
US-20200405760-A1 COMPOSITIONS AND METHODS FOR CAR T CELL THERAPY CD47, PBK, GZMB CA9 542/4885CA1 1175/4885CA2 3139/4885

“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.

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