SCHEMBL4775429

SCHEMBL4775429

O=C(N(c1cccc(C(F)(F)F)c1)c1ccc2c(c1)CCN(C1CCC1)CC2)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM2B Q8NHM5 2/20 0.42
MCHR1 Q99705 2/20 0.41
HRH3 Q9Y5N1 8/20 0.40
HTR7 P34969 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL4774283 0.91 HRH3 (0.43) KDM2BHRH3CYP2D6
SCHEMBL4770829 0.85 HRH3 (0.45) KDM2BHRH3CYP2D6
SCHEMBL4770278 0.84 HRH3 (0.60) HRH3CYP2D6
SCHEMBL4770408 0.83 HRH3 (0.43) KDM2BMCHR1HRH3CYP2D6
SCHEMBL4771920 0.83 HRH3 (0.42) KDM2BHRH3ALDH1A1SMN1; SMN2CYP2D6
SCHEMBL4765539 0.82 HRH3 (0.62) HRH3CYP2D6
SCHEMBL4767950 0.82 HRH3 (0.48) KDM2BHRH3CYP2D6
SCHEMBL4774148 0.81 HRH3 (0.44) KDM2BHRH3CYP2D6
SCHEMBL4775800 0.79 FKBP1A (0.44) HRH3ALDH1A1CYP2D6
SCHEMBL4770320 0.77 HRH3 (0.53) HRH3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP claimed
US-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists GLAXO GROUP LIMITED (GB) 2007-03-15 US claimed
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP 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-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists HRH3, HRH4, HRH1 KDM2B 369/4885MCHR1 765/4885HRH3 1/4885

“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.