SCHEMBL21930396

SCHEMBL21930396

COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)c2ccc3c(c2)NCC2(CCCc4cc(Cl)ccc42)CO3)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 4/20 0.40
CXCR3 P49682 2/20 0.40
MCL1 Q07820 6/20 0.38
DAGLA Q9Y4D2 3/20 0.37
PSEN1 P49768 2/20 0.36
PSEN2 P49810 2/20 0.36
APH1B Q8WW43 2/20 0.36
NCSTN Q92542 2/20 0.36
APH1A Q96BI3 2/20 0.36
PSENEN Q9NZ42 2/20 0.36
ABHD6 Q9BV23 1/20 0.36
BCL2L11 O43521 2/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL30261896 1.00 TAS2R14 (0.40) TAS2R14CXCR3MCL1DAGLAPSEN1
SCHEMBL21930197 1.00 TAS2R14 (0.40) TAS2R14CXCR3MCL1DAGLAPSEN1
SCHEMBL21930389 0.88 TAS2R14 (0.41) TAS2R14CXCR3DAGLAPSEN1PSEN2
SCHEMBL30483467 0.87 ALDH1A1 (0.36) TAS2R14MCL1BCL2L11LMNA
SCHEMBL21930384 0.85 TAS2R14 (0.40) TAS2R14CXCR3PSEN1PSEN2APH1B
SCHEMBL25874011 0.81 MCL1 (0.41) MCL1BCL2L11
SCHEMBL21993713 0.81 PSEN1 (0.45) TAS2R14CXCR3PSEN1PSEN2APH1B
SCHEMBL21930443 0.80 MCL1 (0.63) MCL1BCL2L11
SCHEMBL21930487 0.79 MCL1 (0.41) MCL1BCL2L11
SCHEMBL30261895 0.79 MCL1 (0.41) MCL1BCL2L11

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-20230010358-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein PRELUDE THERAPEUTICS, INCORPORATED 2023-01-12 US disclosed
US-11130769-B2 Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (MCL-1) protein PRELUDE THERAPEUTICS, INCORPORATED (US) 2021-09-28 US disclosed
EP-3877390-A1 SPIRO-SULFONAMIDE DERIVATIVES AS INHIBITORS OF MYELOID CELL LEUKEMIA-1 (MCL-1) PROTEIN Prelude Therapeutics, Incorporated (US) 2021-09-15 EP disclosed
US-20200148705-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein PRELUDE THERAPEUTICS, INCORPORATED 2020-05-14 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 (3 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-11130769-B2 Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (MCL-1) protein MCL1, BCL2A1, BCL2L1 TAS2R14 4194/4885CXCR3 3264/4885MCL1 1/4885
US-20200148705-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein MCL1, BCL2A1, BCL2L1 TAS2R14 4194/4885CXCR3 3264/4885MCL1 1/4885
US-20230010358-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein MCL1, BCL2A1, BCL2L1 TAS2R14 4194/4885CXCR3 3264/4885MCL1 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.