SCHEMBL25897385

SCHEMBL25897385

CN1Cc2cn(C)nc2-c2cccc(Br)c21

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 2/20 0.47
▸ MMP12 P39900 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.33
▸ HSD11B1 P28845 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ NPC1 O15118 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
SCHEMBL30703395 0.82 DRD4 (0.47) DRD4MMP12ALDH1A1
SCHEMBL25897379 0.82 DRD4 (0.47) DRD4MMP12ALDH1A1
SCHEMBL27107101 0.80 DRD4 (0.44) DRD4MMP12ALDH1A1
SCHEMBL25897444 0.79 ACVR1 (0.32) —
SCHEMBL25897398 0.78 DRD4 (0.43) DRD4ALDH1A1HSD11B1
SCHEMBL31607262 0.78 DRD4 (0.43) DRD4ALDH1A1HSD11B1
SCHEMBL25897386 0.75 PBRM1 (0.30) —
SCHEMBL29842935 0.75 DRD4 (0.55) DRD4MMP12ALDH1A1SMN1; SMN2NPC1
SCHEMBL29766599 0.75 DRD4 (0.43) DRD4MMP12
SCHEMBL29766720 0.75 DRD4 (0.40) DRD4MMP12

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
WO-2024042361-A1 TYK2 INHIBITORS AND USES THEREOF SUDO BIOSCIENCES LIMITED (GB) 2024-02-29 — — WO disclosed
US-20230242546-A1 SUBSTITUTED PYRIDINES, PYRIDAZINES, PYRIMIDINES, AND 1,2,4-TRIAZINES AS TYK2 INHIBITORS SUDO BIOSCIENCES LIMITED (GB) 2023-08-03 — — US disclosed
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 DRD4 4303/4885MMP12 3988/4885ALDH1A1 4255/4885

“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.

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