SCHEMBL1786310

SCHEMBL1786310

Cc1nn(C)c(C)c1CNC(=O)c1ccc2c(c1)CCN(C1CCC1)CC2

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.48
RAB9A P51151 4/20 0.42
NPC1 O15118 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HRH1 P35367 1/20 0.41
KDM2B Q8NHM5 2/20 0.41
KMT2A Q03164 1/20 0.40
SHMT2 P34897 1/20 0.40
CYP2D6 P10635 1/20 0.40
SLC5A7 Q9GZV3 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
SCHEMBL1788648 0.86 P2RX7 (0.46) HRH3RAB9ANPC1KMT2A
SCHEMBL1792605 0.85 SLC5A7 (0.50) HRH3RAB9ANPC1SMN1; SMN2HRH1
SCHEMBL1787243 0.83 HRH3 (0.48) HRH3HRH1KDM2BCYP2D6
SCHEMBL1787641 0.83 ALDH1A1 (0.53) HRH3RAB9ANPC1HRH1KDM2B
SCHEMBL1789968 0.83 ROCK2 (0.51) HRH3HRH1KDM2B
SCHEMBL1786312 0.81 RAB9A (0.42) RAB9ANPC1SMN1; SMN2KMT2ASHMT2
SCHEMBL1787684 0.80 NAMPT (0.49) HRH3HRH1KDM2B
SCHEMBL1787645 0.80 HRH3 (0.49) HRH3HRH1KDM2BKMT2A
SCHEMBL12608452 0.80 MAPT (0.53) HRH3KDM2B
SCHEMBL1787359 0.79 TP53 (0.52) HRH3RAB9ASMN1; SMN2HRH1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 HRH3 2/4885RAB9A 2688/4885NPC1 1764/4885

“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.