SCHEMBL25801282

SCHEMBL25801282

COCC1CN(c2nccc(S)c2Cl)C1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 4/20 0.39
CHRM4 P08173 1/20 0.37
CDK8 P49336 2/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
MAP4K4 O95819 1/20 0.33
EGFR P00533 1/20 0.32
MAPK1 P28482 2/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL25801285 0.83 CHRM4 (0.37) PDE10ACHRM4CDK8KDM4EALDH1A1
SCHEMBL25801194 0.82 PDE10A (0.38) PDE10A
SCHEMBL25801258 0.81 PDE10A (0.30) PDE10A
SCHEMBL25801295 0.78 SMO (0.37) EGFR
SCHEMBL24151005 0.78 JAK2 (0.35)
SCHEMBL21855839 0.77 PDE10A (0.47) PDE10A
SCHEMBL21855842 0.77 PDE10A (0.47) PDE10A
SCHEMBL21856096 0.77 PDE10A (0.47) PDE10A
SCHEMBL31387907 0.77 PDE10A (0.47) PDE10A
SCHEMBL21062752 0.76 PDE10A (0.37) PDE10A

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-20230212180-A1 SUBSTITUTED PYRAZINE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-07-06 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-20230212180-A1 SUBSTITUTED PYRAZINE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF PTPN5, PTPN1, PTPN2 PDE10A 354/4885CHRM4 4094/4885CDK8 2839/4885

“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.