SCHEMBL19684600

SCHEMBL19684600

Cc1cc(C(C)(C)O)c(F)c2c1CNCC2

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.36
PNMT P11086 2/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32

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
SCHEMBL23735313 0.88 HTR2A (0.35) HTR6PNMTHTR2AHTR2CHTR2B
SCHEMBL19684829 0.86 PNMT (0.34) HTR6PNMTHTR2AHTR2CHTR2B
SCHEMBL20778247 0.85 HTR6 (0.36) HTR6PNMTHTR2AHTR2CHTR2B
SCHEMBL19684833 0.84 HTR2A (0.35) HTR6PNMTHTR2AHTR2CHTR2B
SCHEMBL19710963 0.84 HTR6 (0.35) HTR6PNMTHTR2AHTR2CHTR2B
SCHEMBL17462475 0.81 PNMT (0.37) HTR6PNMT
SCHEMBL19684784 0.79 PNMT (0.40) HTR6PNMT
SCHEMBL19678859 0.78 HTR2A (0.35) HTR6PNMTHTR2AHTR2CHTR2B
SCHEMBL19684795 0.77 PNMT (0.39) HTR6PNMTHTR2AHTR2CHTR2B
SCHEMBL19678871 0.74 PNMT (0.37) PNMTHTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3464249-B1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER (US) 2021-08-11 EP disclosed
US-10709709-B2 Substituted carbonucleoside derivatives useful as anticancer agents PFIZER INC. (US) 2020-07-14 US disclosed
US-20190111060-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2019-04-18 US disclosed
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2017-12-07 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 (3 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-10709709-B2 Substituted carbonucleoside derivatives useful as anticancer agents DUT, NCL, TYMP HTR6 4627/4885PNMT 2003/4885HTR2A 4697/4885
US-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS DUT, NCL, TYMP HTR6 4627/4885PNMT 2003/4885HTR2A 4697/4885
US-20190111060-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS DUT, NCL, TYMP HTR6 4627/4885PNMT 2003/4885HTR2A 4697/4885

“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.