SCHEMBL26482497

SCHEMBL26482497

Cc1c2cc(C(C)C)c(Cl)cc2nn1C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 6/20 0.36
▸ CHRM4 P08173 5/20 0.33
▸ LMNA P02545 3/20 0.33
▸ MCHR1 Q99705 1/20 0.32
▸ NMT1 P30419 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL10151108 0.81 DHFR (0.31) —
SCHEMBL13106286 0.80 L3MBTL1 (0.43) CHRM4MCHR1NMT1L3MBTL1
SCHEMBL13106187 0.76 CHRM4 (0.41) CHRM4MCHR1NMT1L3MBTL1
SCHEMBL13106332 0.75 L3MBTL1 (0.42) CHRM4MCHR1NMT1L3MBTL1
SCHEMBL13106276 0.72 CHRM4 (0.43) CHRM4MCHR1NMT1
SCHEMBL17348186 0.72 ADORA2A (0.41) CHRM4LMNAMCHR1
SCHEMBL15341789 0.69 RAB9A (0.37) EGLN1CHRM4LMNAMCHR1L3MBTL1
SCHEMBL22357763 0.69 LMNA (0.37) CHRM4LMNATP53L3MBTL1
SCHEMBL13106271 0.68 POLB (0.46) CHRM4LMNAMCHR1HTT
SCHEMBL13106334 0.68 MCHR1 (0.47) CHRM4LMNAMCHR1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230128162-A1 TRIAZINE DERIVATIVES HAVING VIRUS REPLICATION INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME SHIONOGI & CO., LTD. (JP) 2023-04-27 — — US disclosed
US-20230128162-A1 TRIAZINE DERIVATIVES HAVING VIRUS REPLICATION INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME SHIONOGI & CO., LTD. (JP) 2023-04-27 — — 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-20230128162-A1 TRIAZINE DERIVATIVES HAVING VIRUS REPLICATION INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME ACE, ACE2, SARS1 EGLN1 2713/4885CHRM4 3087/4885LMNA 1968/4885

“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.

Send feedback