SCHEMBL4772256

SCHEMBL4772256

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)c1ccc(-n2cncn2)nc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 2/20 0.52
HRH3 Q9Y5N1 8/20 0.49
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 2/20 0.48
POLB P06746 1/20 0.48
GLA P06280 1/20 0.48
HTT P42858 1/20 0.48
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
ROCK2 O75116 1/20 0.44
PKM P14618 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
SCHEMBL4768107 0.87 ROCK2 (0.56) SMN1; SMN2LMNAHRH3ALDH1A1HTT
SCHEMBL4765219 0.86 KDM4E (0.56) SMN1; SMN2LMNAHRH3KDM4EALDH1A1
SCHEMBL4767846 0.83 ROCK2 (0.54) SMN1; SMN2LMNAHRH3KDM4EALDH1A1
SCHEMBL4765396 0.83 HRH3 (0.51) SMN1; SMN2HRH3HTTMAPTRAB9A
SCHEMBL4765153 0.82 ADRA1A (0.54) SMN1; SMN2LMNAHRH3HTTMAPT
SCHEMBL4774583 0.81 HRH3 (0.57) SMN1; SMN2LMNAHRH3ALDH1A1MAPT
SCHEMBL4774236 0.81 SMN1; SMN2 (0.72) SMN1; SMN2HRH3KDM4EMAPTRAB9A
SCHEMBL4768082 0.81 HRH3 (0.51) SMN1; SMN2LMNAHRH3KDM4EALDH1A1
SCHEMBL4770289 0.81 HRH3 (0.51) SMN1; SMN2LMNAHRH3KDM4EALDH1A1
SCHEMBL4770797 0.79 HRH3 (0.55) SMN1; SMN2LMNAHRH3KDM4EALDH1A1

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 SMN1; SMN2 2487/4885LMNA 3210/4885HRH3 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.