SCHEMBL7604020

SCHEMBL7604020

CCCCC(CCCC)NC(=N)N(C=O)CCCNC(=O)CC1CC1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.33
EPHX1 P07099 11/20 0.32
EPHX2 P34913 2/20 0.32
PLA2G2C Q5R387 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
FAAH O00519 1/20 0.31
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31

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
SCHEMBL7600641 0.83 PAOX (0.39) DNM1EPHX1PLA2G2CDPP7
SCHEMBL12498822 0.83 NAAA (0.50) EPHX1EPHX2
SCHEMBL12499962 0.80 PAOX (0.41) EPHX1EPHX2PLA2G2CDPP7
SCHEMBL8413414 0.80 EPHX1 (0.46) EPHX1EPHX2PLA2G2CDPP7
SCHEMBL8411133 0.74 HPGD (0.57) EPHX2KEAP1NFE2L2
SCHEMBL8412186 0.74 RECQL (0.51)
SCHEMBL12499872 0.74 ACKR3 (0.46)
SCHEMBL7603785 0.72 NPY5R (0.44) EPHX2
SCHEMBL7603836 0.72 NAAA (0.44)
SCHEMBL12499263 0.71 NAAA (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183252-B2 Heterocyclic aspartyl protease inhibitors SCHERING CORPORATION (US) 2012-05-22 US disclosed
US-20100292203-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS SCHERING CORPORATION 2010-11-18 US 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-20100292203-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS CHRM1, CHRM2, PRSS1 DNM1 1331/4885EPHX1 765/4885EPHX2 821/4885

“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.