SCHEMBL5148648

SCHEMBL5148648

Cn1ncc(CCCO)c1NC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.34
ACSS2 Q9NR19 1/20 0.33
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
KDM4E B2RXH2 1/20 0.32
KCNN4 O15554 2/20 0.32
LPAR1 Q92633 1/20 0.32
ELANE P08246 1/20 0.32
CNR2 P34972 2/20 0.31
CNR1 P21554 1/20 0.31
BCDIN3D Q7Z5W3 2/20 0.31
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
BRD4 O60885 1/20 0.30
BRD9 Q9H8M2 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL5147620 0.87 KIF11 (0.36) ACSS2KDM4EKCNN4BCDIN3DBRD4
SCHEMBL5150635 0.83 HDAC6 (0.38) ACSS2ELANEGAA
SCHEMBL5148585 0.82 MEN1 (0.38) MEN1KMT2A
SCHEMBL5148605 0.79 SIGMAR1 (0.43) CNR2MEN1KMT2AGAA
SCHEMBL5148558 0.79 MEN1 (0.33) MEN1KMT2A
SCHEMBL5148601 0.78 MTNR1B (0.39) LPAR1GAA
SCHEMBL5147593 0.77 CYP4F2 (0.48) POLBKDM4EMEN1KMT2AGAA
SCHEMBL4206941 0.75 HTT (0.41) POLBACSS2KDM4ECNR2CNR1
SCHEMBL4206940 0.73 CNR2 (0.31) ACSS2CNR2CNR1
SCHEMBL3113554 0.73 KCNN4 (0.37) ACSS2KCNN4LPAR1BCDIN3DBRD4

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
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
EP-1392704-A1 CEPHEM COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-03 EP disclosed
WO-2002090364-A1 CEPHEM COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 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-20040248875-A1 Cephem compounds CEP170, C1S, SLC7A1 POLB 3003/4885ACSS2 791/4885CYP11B1 418/4885

“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.