SCHEMBL1787747

SCHEMBL1787747

CCC(=O)N1CCC(CC(=O)O)CC1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.47
ITGB3 P05106 7/20 0.46
ITGA2B P08514 7/20 0.46
EPHX1 P07099 2/20 0.44
ALDH1A1 P00352 2/20 0.42
BLM P54132 1/20 0.42
NAMPT P43490 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
SCHEMBL15874471 0.89 TACR3 (0.42) EPHX2ITGB3ITGA2BEPHX1ALDH1A1
SCHEMBL15874470 0.89 TACR3 (0.42) EPHX2ITGB3ITGA2BEPHX1ALDH1A1
SCHEMBL23842029 0.85 EPHX2 (0.47) EPHX2EPHX1ALDH1A1BLMNAMPT
SCHEMBL16077702 0.82 EPHX2 (0.51) EPHX2EPHX1ALDH1A1BLM
SCHEMBL4487574 0.82 EPHX2 (0.51) EPHX2EPHX1ALDH1A1BLM
SCHEMBL14610967 0.81 ITGB3 (0.60) ITGB3ITGA2BALDH1A1NAMPT
SCHEMBL23842030 0.80 EPHX2 (0.44) EPHX2EPHX1ALDH1A1NAMPT
SCHEMBL14611310 0.80 ALDH1A1 (0.43) ITGB3ITGA2BALDH1A1
SCHEMBL14610970 0.80 ITGB3 (0.43) ITGB3ITGA2BALDH1A1NAMPT
SCHEMBL2422675 0.80 EPHX2 (0.42) EPHX2ITGB3ITGA2BEPHX1

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
WO-2015103509-A1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-07-09 WO disclosed
CN-102099339-A Benzazepine derivatives and their use as hstamine h3 antagonists 武田药品工业株式会社 2011-06-15 CN disclosed
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 EPHX2 749/4885ITGB3 1426/4885ITGA2B 3530/4885

“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.