SCHEMBL20687705

SCHEMBL20687705

CNc1cccn(-c2ccccn2)c1=O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 16/20 0.53
SMN1; SMN2 Q16637 1/20 0.44
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
JAK1 P23458 2/20 0.42
STAT3 P40763 1/20 0.42
JAK2 O60674 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL21285310 0.84 TYK2 (0.45) TYK2SMN1; SMN2POLBGAATSHR
SCHEMBL20697240 0.84 TYK2 (0.49) TYK2SMN1; SMN2POLBGAATSHR
SCHEMBL16794644 0.81 TYK2 (0.50) TYK2SMN1; SMN2POLBGAATSHR
SCHEMBL8466158 0.79 SMN1; SMN2 (0.51) TYK2SMN1; SMN2POLBGAATSHR
SCHEMBL20687706 0.78 TYK2 (0.54) TYK2
SCHEMBL24263537 0.78 TYK2 (0.70) TYK2
SCHEMBL21258495 0.77 TYK2 (0.46) TYK2GAA
SCHEMBL16794627 0.77 PTK2 (0.45) SMN1; SMN2POLBGAATSHR
SCHEMBL29962532 0.77 PTK2 (0.45) SMN1; SMN2POLBGAATSHR
SCHEMBL20688074 0.77 TYK2 (0.48) TYK2SMN1; SMN2POLBGAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230056447-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-02-23 US disclosed
WO-2020154474-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2020-07-30 WO disclosed
WO-2019023468-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2019-01-31 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-20230056447-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 TYK2 1/4885SMN1; SMN2 1145/4885POLB 1657/4885

“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.