SCHEMBL1904680

SCHEMBL1904680

CCN1CCc2c(c3cc(Br)ccc3n2CCc2cncc(F)c2)C1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 15/20 0.52
HTR6 P50406 16/20 0.51
BCHE P06276 1/20 0.45
GRIN2B Q13224 1/20 0.44
ADRA2A P08913 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR7 P34969 1/20 0.43
ADRA1A P35348 1/20 0.43

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
SCHEMBL1904309 0.91 HRH1 (0.62) HRH1HTR6BCHEGRIN2B
SCHEMBL1905390 0.90 HRH1 (0.53) HRH1HTR6BCHEGRIN2BADRA2A
SCHEMBL1907947 0.90 HRH1 (0.60) HRH1HTR6BCHEGRIN2BADRA2A
SCHEMBL1907819 0.89 HRH1 (0.65) HRH1HTR6BCHEGRIN2BADRA2A
SCHEMBL1903174 0.89 HRH1 (0.52) HRH1HTR6BCHEGRIN2BADRA2A
SCHEMBL1907946 0.88 HTR6 (0.56) HRH1HTR6BCHEGRIN2B
SCHEMBL1905300 0.87 HTR6 (0.62) HRH1HTR6BCHEGRIN2BADRA2A
SCHEMBL1901716 0.87 HTR6 (0.59) HRH1HTR6BCHE
SCHEMBL1908100 0.85 HRH1 (0.49) HRH1HTR6BCHEGRIN2B
SCHEMBL1902978 0.82 HRH1 (0.60) HRH1HTR6BCHE

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-7935823-B2 Fluoro-containing derivatives of hydrogenated pyrido[4,3-b]indoles with neuroprotective and cognition enhancing properties, process for preparing, and use D2E, LLC (US) 2011-05-03 US claimed
US-20100056790-A1 FLUORO-CONTAINING DERIVATIVES OF HYDROGENATED PYRIDO[4,3-B]INDOLES WITH NEUROPROTECTIVE AND COGNITION ENHANCING PROPERTIES, PROCESS FOR PREPARING, AND USE D2E, LLC (US) 2010-03-04 US claimed

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-20100056790-A1 FLUORO-CONTAINING DERIVATIVES OF HYDROGENATED PYRIDO[4,3-B]INDOLES WITH NEUROPROTECTIVE AND COGNITION ENHANCING PROPERTIES, PROCESS FOR PREPARING, AND USE HTR4, SNCA, HTR2B HRH1 1357/4885HTR6 8/4885BCHE 74/4885

“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.