SCHEMBL18934294

SCHEMBL18934294

Cc1ccc(-c2n[nH]c3c2CNCC3)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 9/20 0.80
HTR2A P28223 5/20 0.80
HTR2C P28335 5/20 0.80
HTR2B P41595 5/20 0.80
HTR1D P28221 4/20 0.80
HTR1E P28566 4/20 0.80
HTR6 P50406 4/20 0.80
SOS1 Q07889 1/20 0.73
MAPT P10636 1/20 0.65
HPGD P15428 1/20 0.65
HTR1A P08908 1/20 0.57
HTR3A P46098 1/20 0.47
HTR5A P47898 1/20 0.47

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
SCHEMBL20546707 0.89 HTR7 (1.00) HTR7HTR2AHTR2CHTR2BHTR1D
SCHEMBL12340041 0.84 SOS1 (1.00) HTR7HTR2AHTR2CHTR2BHTR1D
SCHEMBL5644368 0.84 HTR7 (0.80) HTR7HTR2AHTR2CHTR2BHTR1D
SCHEMBL10818201 0.84 HTR7 (0.79) HTR7HTR2AHTR2CHTR2BHTR1D
SCHEMBL10817002 0.84 SOS1 (0.68) HTR7HTR2AHTR2CHTR2BHTR1D
Hydrochloric Acid SCHEMBL30785564 0.83 HTR7 (0.78) HTR7HTR2AHTR2CHTR2BHTR1D
Hydrochloric Acid SCHEMBL3441395 0.83 SOS1 (0.97) HTR7HTR2AHTR2CHTR2BHTR1D
Hydrochloric Acid SCHEMBL2258457 0.83 HTR7 (0.77) HTR7HTR2AHTR2CHTR2BHTR1D
SCHEMBL807194 0.83 SOS1 (0.70) HTR7HTR2AHTR2CHTR2BHTR1D
SCHEMBL10818194 0.82 SOS1 (0.69) HTR7HTR2AHTR2CHTR2BHTR1D

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-20200181142-A1 Derivatives And Methods Of Treating Hepatitis B Infections NOVIRA THERAPEUTICS INC (US) 2020-06-11 US disclosed
US-20170158691-A1 Derivatives And Methods Of Treating Hepatitis B Infections NOVIRA THERAPEUTICS, INC. 2017-06-08 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-20200181142-A1 Derivatives And Methods Of Treating Hepatitis B Infections HAVCR2, PYGL, HCCS HTR7 4347/4885HTR2A 4242/4885HTR2C 4521/4885
US-20170158691-A1 Derivatives And Methods Of Treating Hepatitis B Infections HAVCR2, PYGL, HCCS HTR7 4347/4885HTR2A 4242/4885HTR2C 4521/4885

“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.