SCHEMBL29328237

SCHEMBL29328237

CC(C)c1c(Cl)cc(F)c2c1CCO2

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 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
SCHEMBL29328231 0.84 HTR2A (0.32) HTR2AHTR2CHTR2B
SCHEMBL29326101 0.83 HTR2A (0.30) HTR2AHTR2CHTR2B
SCHEMBL29326105 0.81 HTR2A (0.30) HTR2AHTR2CHTR2B
SCHEMBL29328235 0.80 EGFR (0.35) EGFR
SCHEMBL27376952 0.79 EED (0.32) HTR2AHTR2CHTR2B
SCHEMBL29328234 0.77
SCHEMBL29328229 0.73 MAPK1 (0.35)
SCHEMBL27376978 0.72 HTR2A (0.33) HTR2AHTR2CHTR2B
SCHEMBL29326111 0.70 HTR2A (0.32) HTR2AHTR2CHTR2B
SCHEMBL12533369 0.70 HTR4 (0.33)

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-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2024-07-18 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-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE EGFR 2567/4885HTR2A 2757/4885HTR2C 1491/4885

“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.