SCHEMBL19982252

SCHEMBL19982252

CC(C)c1ccc(F)c2c1CCO2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.31
HTR2C P28335 2/20 0.31
HTR2B P41595 2/20 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
SCHEMBL6124122 0.89 HTR2A (0.34) HTR2AHTR2CHTR2B
SCHEMBL8737441 0.84 MAOA (0.37) HTR2AHTR2CHTR2B
SCHEMBL19297008 0.81 HTR2C (0.33) HTR2AHTR2CHTR2B
SCHEMBL8737437 0.80 MAOA (0.40) HTR2AHTR2CHTR2B
SCHEMBL22016767 0.79 HTR2A (0.31) HTR2AHTR2CHTR2B
SCHEMBL8053197 0.77 MAOA (0.43) HTR2AHTR2CHTR2B
SCHEMBL26700017 0.76 PARP1 (0.33) HTR2AHTR2CHTR2B
SCHEMBL25146229 0.76
SCHEMBL17658864 0.76 MAPT (0.35)
SCHEMBL22016768 0.75 HTR2A (0.31) HTR2AHTR2CHTR2B

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-10662214-B2 Compound of 4′-thionucleoside, as well as preparation method therefor, pharmaceutical composition thereof and application thereof Sichuan Keiun-Biotech Biopharmaceutical Co., Ltd. (CN) 2020-05-26 US disclosed
US-20180079770-A1 NOVEL COMPOUND OF 4'-THIONUCLEOSIDE, AS WELL AS PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2018-03-22 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 (2 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-10662214-B2 Compound of 4′-thionucleoside, as well as preparation method therefor, pharmaceutical composition thereof and application thereof TYMP, WEE1, NTPCR HTR2A 4854/4885HTR2C 4798/4885HTR2B 4809/4885
US-20180079770-A1 NOVEL COMPOUND OF 4'-THIONUCLEOSIDE, AS WELL AS PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF WEE1, WEE2, THEM6 HTR2A 4872/4885HTR2C 4805/4885HTR2B 4817/4885

“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.