SCHEMBL21096567

SCHEMBL21096567

CC(C)c1cn(-c2nc(N)nc3ccsc23)c2cc(C#CC(C)(C)O)ncc12

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TTBK1 Q5TCY1 14/20 0.44
MAP3K14 Q99558 5/20 0.35
CHUK O15111 3/20 0.34
TTBK2 Q6IQ55 3/20 0.34

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
SCHEMBL21096569 0.84 TTBK1 (0.42) TTBK1MAP3K14CHUKTTBK2
SCHEMBL21096566 0.83 TTBK1 (0.59) TTBK1MAP3K14CHUK
SCHEMBL21096518 0.82 TTBK1 (0.59) TTBK1MAP3K14TTBK2
SCHEMBL21096522 0.81 TTBK1 (0.41) TTBK1MAP3K14CHUKTTBK2
SCHEMBL21096561 0.81 ADORA2A (0.34)
SCHEMBL16610252 0.77 TTBK1 (0.70) TTBK1MAP3K14TTBK2
SCHEMBL21096556 0.74 TTBK1 (0.37) TTBK1CHUK
SCHEMBL21096534 0.71 TTBK1 (0.52) TTBK1MAP3K14TTBK2
SCHEMBL16610196 0.70 TTBK1 (0.44) TTBK1MAP3K14CHUKTTBK2
SCHEMBL21096545 0.69 ADORA2A (0.34)

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-10323045-B2 Thienopyrimidine derivatives as NIK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2019-06-18 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-10323045-B2 Thienopyrimidine derivatives as NIK inhibitors MAP3K14, MAP3K15, MAP3K12 TTBK1 317/4885MAP3K14 1/4885CHUK 31/4885

“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.