SCHEMBL1789555

SCHEMBL1789555

O=C(NCc1ccc2[nH]ccc2c1)c1ccc2c(c1)CCN(C1CCC1)CC2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.49
CHRM2 P08172 1/20 0.46
PRMT5 O14744 1/20 0.46
WDR77 Q9BQA1 1/20 0.46
HRH3 Q9Y5N1 4/20 0.45
EPHX2 P34913 2/20 0.43
PPARG P37231 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ROCK2 O75116 1/20 0.42
KDM2B Q8NHM5 2/20 0.42
CHRNA7 P36544 1/20 0.42
METTL3 Q86U44 1/20 0.41
METTL14 Q9HCE5 1/20 0.41
CACNA1G O43497 1/20 0.41
CACNA1H O95180 1/20 0.41
CACNA1I Q9P0X4 1/20 0.41

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
SCHEMBL1789577 0.82 HRH3 (0.51) HRH3EPHX2KDM2BMAPK14
SCHEMBL4768412 0.82 MAOA (0.53) CHRM2PRMT5WDR77HRH3MAPT
SCHEMBL1789559 0.81 PRMT5 (0.46) CCR3PRMT5WDR77EPHX2PPARG
SCHEMBL12608452 0.81 MAPT (0.53) HRH3ALDH1A1MAPTKDM2B
SCHEMBL1787758 0.81 HRH3 (0.53) HRH3MAPTKDM2B
SCHEMBL1788806 0.81 HRH3 (0.54) HRH3KDM4EALDH1A1MAPTHPGD
SCHEMBL1789976 0.80 CHRNA7 (0.53) HRH3EPHX2PPARGKDM2BCHRNA7
SCHEMBL1789723 0.80 HRH3 (0.66) HRH3EPHX2MAPTKDM2BMAPK14
SCHEMBL1786902 0.79 HRH3 (0.53) HRH3MAPTKDM2BMAPK14
SCHEMBL1792317 0.79 HRH3 (0.48) HRH3KDM2BMAPK14

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2326625-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HSTAMINE H3 ANTAGONISTS Takeda Pharmaceutical Company Limited (JP) 2011-06-01 EP disclosed
US-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-26 US disclosed
US-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-26 US disclosed
US-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-26 US disclosed
WO-2010007382-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HSTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED. (JP) 2010-01-21 WO disclosed
WO-2010007382-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HSTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED. (JP) 2010-01-21 WO 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-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS HRH4, HRH3, HRH2 CCR3 129/4885CHRM2 24/4885PRMT5 1438/4885

“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.