SCHEMBL25875974

SCHEMBL25875974

COc1cc(C)c(Sc2cnc(NC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)s2)cc1C(=O)N1CCN(C(C)=O)CC1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITK Q08881 12/20 0.77
BTK Q06187 10/20 0.71
TXK P42681 9/20 0.71
PRKD3 O94806 1/20 0.71
PRKCG P05129 1/20 0.71
PRKCB P05771 1/20 0.71
INSR P06213 1/20 0.71
LCK P06239 1/20 0.71
FYN P06241 1/20 0.71
PRKCA P17252 1/20 0.71
PRKCH P24723 1/20 0.71
CDK2 P24941 1/20 0.71
LTK P29376 1/20 0.71
PRKCI P41743 1/20 0.71
TEC P42680 1/20 0.71
GSK3B P49841 1/20 0.71
IL2 P60568 1/20 0.71
PRKCE Q02156 1/20 0.71
PRKCQ Q04759 1/20 0.71
PRKCZ Q05513 1/20 0.71

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
SCHEMBL25875995 0.93 BTK (0.67) ITKBTKTXKPRKD3PRKCG
SCHEMBL25875978 0.92 ITK (0.77) ITKBTKTXKPRKD3PRKCG
SCHEMBL25876723 0.90 ITK (0.76) ITKBTKTXKPRKD3PRKCG
SCHEMBL25306587 0.90 ITK (0.76) ITKBTKTXKPRKD3PRKCG
SCHEMBL30291430 0.90 ITK (0.76) ITKBTKTXKPRKD3PRKCG
SCHEMBL24146473 0.87 ITK (0.87) ITKBTKTXKPRKD3PRKCG
SCHEMBL24146348 0.87 ITK (0.70) ITKBTKTXKPRKD3PRKCG
SCHEMBL24146347 0.87 ITK (0.70) ITKBTKTXKPRKD3PRKCG
SCHEMBL25876204 0.87 ITK (0.71) ITKBTKTXKPRKD3PRKCG
SCHEMBL14460665 0.87 ITK (1.00) ITKBTKTXKPRKD3PRKCG

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-20230226196-A1 COMPOUNDS FOR TARGETED DEGRADATION OF INTERLEUKIN-2-INDUCIBLE T-CELL KINASE AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-07-20 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-20230226196-A1 COMPOUNDS FOR TARGETED DEGRADATION OF INTERLEUKIN-2-INDUCIBLE T-CELL KINASE AND METHODS OF USE ITK, IKZF2, PBK ITK 1/4885BTK 672/4885TXK 47/4885

“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.