SCHEMBL4765222

SCHEMBL4765222

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)c1ccc(C(F)(F)F)nc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.52
MAPT P10636 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TRPV4 Q9HBA0 1/20 0.48
ACKR3 P25106 2/20 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
SCHEMBL4768203 0.86 TRPV4 (0.59) HRH3MAPTRAB9ASMN1; SMN2TRPV4
SCHEMBL4774236 0.85 SMN1; SMN2 (0.72) HRH3MAPTRAB9ASMN1; SMN2
SCHEMBL4774583 0.85 HRH3 (0.57) HRH3MAPTRAB9ASMN1; SMN2
SCHEMBL1787453 0.84 HRH3 (0.50) HRH3
SCHEMBL4770797 0.82 HRH3 (0.55) HRH3MAPTRAB9ASMN1; SMN2
SCHEMBL4772145 0.82 MAPK14 (0.53) MAPTRAB9ASMN1; SMN2TRPV4
Trifluoroacetic Acid SCHEMBL4774281 0.82 SLC2A1 (0.58) HRH3MAPTRAB9ASMN1; SMN2TRPV4
SCHEMBL4770439 0.82 HRH3 (0.52) HRH3MAPTRAB9ASMN1; SMN2
SCHEMBL4768058 0.81 NPC1 (0.69) HRH3MAPTRAB9ASMN1; SMN2
SCHEMBL4768082 0.81 HRH3 (0.51) HRH3MAPTRAB9ASMN1; SMN2

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 HRH3 1/4885MAPT 405/4885RAB9A 2307/4885

“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.