SCHEMBL4771957

SCHEMBL4771957

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)Nc1cccc2c1OC(F)(F)O2

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.48
NPC1 O15118 12/20 0.44
RAB9A P51151 12/20 0.44
CXCR2 P25025 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CASP3 P42574 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
HRH3 Q9Y5N1 1/20 0.41
KIT P10721 1/20 0.41
BRAF P15056 1/20 0.41
JAK2 O60674 3/20 0.40
JAK3 P52333 3/20 0.40
PTK2 Q05397 3/20 0.40
SENP8 Q96LD8 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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 0.77 NPC1 (0.67) NPC1RAB9AMEN1KMT2ACASP3
SCHEMBL4774316 0.75 NPC1 (0.72) NPC1RAB9AMEN1KMT2ACASP3
SCHEMBL4775079 0.75 MEN1 (0.52) NPC1RAB9AMEN1KMT2ACASP3
SCHEMBL4772782 0.75 NPC1 (0.54) NPC1RAB9AMEN1KMT2ACASP3
SCHEMBL4771412 0.74 NPC1 (0.70) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL4777033 0.74 HRH3 (0.39) HRH3JAK2JAK3PTK2
SCHEMBL4774290 0.73 HRH3 (0.50) NPC1RAB9AMEN1KMT2AHRH3
SCHEMBL4770984 0.73 RORC (0.54) NPC1RAB9AMEN1KMT2ACASP3
SCHEMBL5459684 0.72 HRH3 (0.53) NPC1RAB9AMEN1KMT2AHRH3
SCHEMBL4774168 0.72 HRH3 (0.53) NPC1RAB9AMEN1KMT2AHRH3

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-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 BTK 3106/4885NPC1 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.