SCHEMBL4774290

SCHEMBL4774290

O=C(Nc1ccncc1)Nc1ccc2c(c1)CCN(C1CCC1)CC2

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.50
NPC1 O15118 6/20 0.50
RAB9A P51151 6/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
POLB P06746 4/20 0.49
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
MDM2 Q00987 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
HSD17B10 Q99714 1/20 0.44
EPHX1 P07099 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL4768190 0.88 NPC1 (0.67) HRH3NPC1RAB9AMEN1KMT2A
SCHEMBL4768020 0.87 SLC2A1 (0.53) HRH3NPC1RAB9AKDM4EALDH1A1
SCHEMBL4770941 0.86 NPC1 (0.60) HRH3NPC1RAB9AMEN1KMT2A
SCHEMBL4775935 0.84 EPHX1 (0.48) HRH3NPC1RAB9AMEN1KMT2A
SCHEMBL4770268 0.83 CREBBP (0.55) HRH3NPC1RAB9AMEN1KMT2A
SCHEMBL5459684 0.82 HRH3 (0.53) HRH3NPC1RAB9AMEN1KMT2A
SCHEMBL4774168 0.82 HRH3 (0.53) HRH3NPC1RAB9AMEN1KMT2A
SCHEMBL4765684 0.82 NAMPT (0.47) HRH3NPC1RAB9ALMNA
SCHEMBL4772402 0.81 HRH3 (0.66) HRH3NPC1RAB9AKDM4EALDH1A1
SCHEMBL4765613 0.81 EPHX2 (0.53) NPC1RAB9AMEN1KMT2AKDM4E

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 1/4885NPC1 2009/4885RAB9A 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.