SCHEMBL4766844

SCHEMBL4766844

COc1ccc(Cl)cc1NC(=O)Nc1ccc2c(c1)CCN(C1CCC1)CC2

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.58
MEN1 O00255 5/20 0.58
CASP3 P42574 1/20 0.58
SENP7 Q9BQF6 1/20 0.58
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
TDP1 Q9NUW8 1/20 0.51
MAPT P10636 4/20 0.49
GAA P10253 2/20 0.49
ALDH1A1 P00352 2/20 0.49
POLB P06746 2/20 0.48
IDH1 O75874 1/20 0.48
DRD2 P14416 1/20 0.47
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47
SHMT2 P34897 1/20 0.47
THRB P10828 1/20 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
SCHEMBL4774316 0.87 NPC1 (0.72) KMT2AMEN1CASP3SENP7NPC1
SCHEMBL4768074 0.79 CA1 (0.54) KMT2AMEN1CASP3SENP7NPC1
SCHEMBL4768190 0.77 NPC1 (0.67) KMT2AMEN1CASP3SENP7NPC1
SCHEMBL4765163 0.76 HTR2C (0.54) KMT2ANPC1RAB9AMAPT
SCHEMBL4768212 0.76 NPC1 (0.58) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL4774168 0.76 HRH3 (0.53) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL4772402 0.75 HRH3 (0.66) NPC1RAB9AMAPTALDH1A1
SCHEMBL4772782 0.75 NPC1 (0.54) KMT2AMEN1CASP3SENP7NPC1
SCHEMBL4774290 0.75 HRH3 (0.50) KMT2AMEN1NPC1RAB9ATDP1
SCHEMBL12316787 0.75 KMT2A (0.82) KMT2AMEN1NPC1RAB9AMAPT

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 KMT2A 99/4885MEN1 2213/4885CASP3 2205/4885

“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.