SCHEMBL25898111

SCHEMBL25898111

CCC(C)c1c[nH]nc1C

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
RORC P51449 1/20 0.35
NISCH Q9Y2I1 1/20 0.33
AR P10275 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL22758623 0.80 GPR84 (0.38) ALDH1A1
SCHEMBL10174668 0.79
SCHEMBL23547487 0.79 TSHR (0.35) TSHRRORCNISCHARALDH1A1
SCHEMBL18895150 0.76
SCHEMBL29303851 0.72 TSHR (0.42) TSHRNISCH
SCHEMBL18885139 0.72 TSHR (0.42) TSHRNISCHALDH1A1
SCHEMBL24403166 0.72 TSHR (0.41) TSHRRORCALDH1A1
SCHEMBL26771794 0.71 NR1I2 (0.30)
SCHEMBL21216910 0.70 NR1I2 (0.36) ALDH1A1
SCHEMBL5835995 0.70 PDE4D (0.32)

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-20230242546-A1 SUBSTITUTED PYRIDINES, PYRIDAZINES, PYRIMIDINES, AND 1,2,4-TRIAZINES AS TYK2 INHIBITORS SUDO BIOSCIENCES LIMITED (GB) 2023-08-03 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-20230242546-A1 SUBSTITUTED PYRIDINES, PYRIDAZINES, PYRIMIDINES, AND 1,2,4-TRIAZINES AS TYK2 INHIBITORS TYK2, PDXK, JAK1 TSHR 1509/4885RORC 281/4885NISCH 2940/4885

“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.