SCHEMBL19684825

SCHEMBL19684825

Cc1ccc(F)c2c1CNCC2

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.41
HTR2A P28223 1/20 0.41
HTR2B P41595 1/20 0.41
HTR6 P50406 3/20 0.39
PNMT P11086 4/20 0.36
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
CD44 P16070 1/20 0.34

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
SCHEMBL11981382 0.86 HTR2C (0.44) HTR2CPNMTADRA2AADRA2BADRA2C
SCHEMBL2258843 0.86 HTR2C (0.47) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL8273041 0.84 HTR2C (0.33) HTR2CHTR6
Hydrochloric Acid SCHEMBL1198541 0.84 HTR2C (0.46) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL16518181 0.79 HTR7 (0.43) HTR2CHTR2AHTR2BHTR6
SCHEMBL19711549 0.77 HTR2A (0.41) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL13184322 0.77 PNMT (0.53) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL16518063 0.77 ERN1 (0.41) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL15056295 0.77 HTR2C (0.41) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL16518020 0.77 HTR2C (0.45) HTR2CHTR2AHTR2BHTR6PNMT

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-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 (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-20170348313-A1 SUBSTITUTED CARBONUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS DUT, NCL, TYMP HTR2C 4759/4885HTR2A 4697/4885HTR2B 4558/4885

“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.