SCHEMBL1787825

SCHEMBL1787825

Cc1nc(CNC(=O)c2ccc3c(c2)CCN(C2=CC=C2)CC3)c(C)o1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
POLB P06746 2/20 0.38
HDAC6 Q9UBN7 4/20 0.35
KMT2A Q03164 1/20 0.35
TP53 P04637 4/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35
HDAC11 Q96DB2 1/20 0.34

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
SCHEMBL1788046 0.87 MAPT (0.52) MAPTPOLBKMT2ATP53LMNA
SCHEMBL1787618 0.82 ROCK2 (0.46) MAPTHDAC6KMT2ATP53
SCHEMBL1788120 0.81 HDAC6 (0.37) MAPTPOLBHDAC6KMT2ATP53
SCHEMBL1789744 0.81 TP53 (0.38) POLBTP53LMNA
SCHEMBL1787823 0.81 HRH3 (0.48) MAPT
SCHEMBL1789608 0.80 NAMPT (0.49) MAPTHDAC6KMT2ALMNA
SCHEMBL1787706 0.79 HDAC6 (0.43) HDAC6KMT2ATP53
SCHEMBL1787647 0.78 KMT2A (0.47) HDAC6KMT2ATP53LMNA
SCHEMBL1789725 0.78 EPHX2 (0.48) MAPTHDAC6KMT2ATP53LMNA
SCHEMBL1791894 0.78 ALDH1A1 (0.48) MAPTPOLBKMT2ALMNA

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-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
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 MAPT 3598/4885POLB 4401/4885HDAC6 683/4885

“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.