SCHEMBL1789359

SCHEMBL1789359

Cn1nccc1NC(=O)Cc1ccc2c(c1)CCN(C1CCC1)CC2

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
LMNA P02545 2/20 0.43
HRH3 Q9Y5N1 13/20 0.42
HPGD P15428 4/20 0.41
CYP2D6 P10635 4/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 2/20 0.40
CYP2C9 P11712 1/20 0.40
HRH1 P35367 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL1789591 0.81 HRH3 (0.56) ALDH1A1LMNAHRH3CYP2D6HRH1
SCHEMBL1789361 0.80 ALDH1A1 (0.40) ALDH1A1LMNAHPGDCYP2D6CYP1A2
SCHEMBL1788015 0.78 LMNA (0.55) LMNAHRH3CYP2D6HRH1KMT2A
SCHEMBL1790056 0.78 HRH3 (0.55) ALDH1A1LMNAHRH3HPGDCYP2D6
SCHEMBL12608382 0.77 HRH3 (0.51) HRH3CYP2D6HRH1
SCHEMBL1788739 0.76 HRH3 (0.48) HRH3CYP2D6
SCHEMBL1786584 0.76 HPGD (0.46) HRH3HPGDCYP2D6
SCHEMBL1786862 0.75 HRH3 (0.61) ALDH1A1LMNAHRH3SMN1; SMN2MAPT
SCHEMBL1790555 0.74 HRH3 (0.49) HRH3CYP2D6
Potassium Ion SCHEMBL1787639 0.74 HRH3 (0.49) HRH3CYP2D6

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 5 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
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 ALDH1A1 1526/4885LMNA 2172/4885HRH3 2/4885

“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.