SCHEMBL5148601

SCHEMBL5148601

COC(=O)NCCc1cnn(C)c1NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 5/20 0.39
MTNR1A P48039 5/20 0.39
LTA4H P09960 3/20 0.37
PLA2G2A P14555 3/20 0.37
FAAH O00519 4/20 0.37
GAA P10253 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
LPAR1 Q92633 1/20 0.35
TRPV1 Q8NER1 1/20 0.33
CCKBR P32239 1/20 0.33
TRPV4 Q9HBA0 1/20 0.33

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
SCHEMBL5148605 0.84 SIGMAR1 (0.43) GAA
SCHEMBL5150635 0.82 HDAC6 (0.38) GAA
SCHEMBL6426568 0.81 MEN1 (0.38) LPAR1TRPV4
SCHEMBL5148558 0.80 MEN1 (0.33)
SCHEMBL5147593 0.79 CYP4F2 (0.48) GAA
SCHEMBL5148648 0.78 POLB (0.34) GAALPAR1
SCHEMBL6425375 0.78 LPAR1 (0.36) GAANPC1RAB9ALPAR1
SCHEMBL5148585 0.76 MEN1 (0.38)
SCHEMBL5147620 0.76 KIF11 (0.36)
SCHEMBL5492718 0.72 BCHE (0.40)

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
US-7179801-B2 Cephem compounds ASTELLAS PHARMA INC. (JP) 2007-02-20 US disclosed
EP-1392704-B1 CEPHEM COMPOUNDS ASTELLAS PHARMA INC (JP) 2006-02-22 EP disclosed
US-20040248875-A1 Cephem compounds ASTELLAS PHARMA INC. (JP) 2004-12-09 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-20040248875-A1 Cephem compounds CEP170, C1S, SLC7A1 MTNR1B 2879/4885MTNR1A 2694/4885LTA4H 2087/4885

“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.