SCHEMBL23409028

SCHEMBL23409028

CNCCNc1ncnc2[nH]ccc12

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TTBK1 Q5TCY1 8/20 0.59
TTBK2 Q6IQ55 8/20 0.59
BTK Q06187 4/20 0.49
HDAC6 Q9UBN7 1/20 0.48
HPGDS O60760 1/20 0.48
TNNI3K Q59H18 1/20 0.46

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
Hydrochloric Acid SCHEMBL29729076 0.98 TTBK1 (0.58) TTBK1TTBK2BTKHDAC6HPGDS
SCHEMBL16266363 0.85 TTBK1 (0.61) TTBK1TTBK2BTKHDAC6TNNI3K
SCHEMBL22909512 0.84 TTBK1 (0.57) TTBK1TTBK2BTKHDAC6HPGDS
SCHEMBL29665587 0.83 TTBK1 (0.62) TTBK1TTBK2BTKHDAC6HPGDS
SCHEMBL30485458 0.83 TTBK1 (0.62) TTBK1TTBK2BTKHDAC6HPGDS
SCHEMBL23409027 0.83 TTBK1 (0.62) TTBK1TTBK2BTKHDAC6HPGDS
SCHEMBL28451436 0.83 TTBK1 (0.62) TTBK1TTBK2BTKHDAC6HPGDS
SCHEMBL25069022 0.83 TTBK1 (0.56) TTBK1TTBK2BTKHDAC6HPGDS
Hydrochloric Acid SCHEMBL29729054 0.82 TTBK1 (0.61) TTBK1TTBK2BTKHDAC6HPGDS
SCHEMBL23409023 0.81 GAA (0.57) TTBK1TTBK2BTKHDAC6HPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230055961-A1 PENTAFLUOROBENZENESULFONAMIDE DERIVATIVES AND USES THEREOF DUNAD THERAPEUTICS LTD. (GB) 2023-02-23 US disclosed
WO-2021099842-A1 PENTAFLUOROBENZENESULFONAMIDE DERIVATIVES AND USES THEREOF 2692372 ONTARIO INC. (CA) 2021-05-27 WO 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-20230055961-A1 PENTAFLUOROBENZENESULFONAMIDE DERIVATIVES AND USES THEREOF FURIN, PFAS, CFTR TTBK1 3603/4885TTBK2 2919/4885BTK 305/4885

“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.