SCHEMBL22969007

SCHEMBL22969007

CN(C(=O)OC(C)(C)C)C1CCc2cc(F)cc(F)c2NC1=O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 5/20 0.41
▸ CRBN Q96SW2 5/20 0.41
▸ RIPK1 Q13546 10/20 0.39
▸ SCN9A Q15858 1/20 0.33
▸ HTR2C P28335 2/20 0.32
▸ SLC6A4 P31645 2/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ TP53 P04637 1/20 0.30
▸ PARP1 P09874 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
SCHEMBL22969010 0.77 RIPK1 (0.40) DDB1CRBNRIPK1SCN9AHTR2C
SCHEMBL19960758 0.77 NR1I2 (0.42) DDB1CRBNRIPK1HTR2CSLC6A4
SCHEMBL22737131 0.77 RIPK1 (0.52) CRBNRIPK1SCN9A
SCHEMBL28714243 0.77 RIPK1 (0.52) CRBNRIPK1SCN9A
SCHEMBL19961242 0.76 PSEN1 (0.39) SCN9AHTR2CSLC6A4HTR2A
SCHEMBL19961238 0.75 NR1I2 (0.36) DDB1CRBNRIPK1HTR2CSLC6A4
SCHEMBL22525924 0.75 PYGL (0.41) DDB1CRBNRIPK1
SCHEMBL23554702 0.72 DDB1 (0.37) DDB1CRBN
SCHEMBL30304239 0.72 DDB1 (0.37) DDB1CRBN
SCHEMBL25551342 0.70 RIPK1 (0.43) DDB1CRBNRIPK1HTR2CHTR2A

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-20210040115-A1 FUSED RING HETEROARYL COMPOUNDS AS RIPK1 INHIBITORS BISICHEM CO., LTD. (KR) 2021-02-11 — — 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-20210040115-A1 FUSED RING HETEROARYL COMPOUNDS AS RIPK1 INHIBITORS RIPK1, RIPK3, RIPK4 DDB1 1028/4885CRBN 4478/4885RIPK1 1/4885

“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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