SCHEMBL5263897

SCHEMBL5263897

CC[C@@](Cc1ccc(Nc2nc(C)cc3ccncc23)cc1)(NC1=C(C2CCCCC2)C(=O)CC1)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRMT3 O60678 2/20 0.32
IGF1R P08069 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPY5R Q15761 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
SCHEMBL5263895 1.00 PRMT3 (0.32) PRMT3IGF1RMEN1KMT2ANPY5R
SCHEMBL5260905 0.82 ITGB1 (0.35)
SCHEMBL5260895 0.82 ITGB1 (0.35)
SCHEMBL5263890 0.80 CSNK2A1 (0.31) NPY5R
SCHEMBL5263887 0.80 BRAF (0.33) MEN1KMT2A
SCHEMBL3835883 0.79 ITGB1 (0.36) PRMT3MEN1KMT2A
SCHEMBL3835522 0.79 ITGB1 (0.37) MEN1KMT2A
SCHEMBL2980731 0.73 MEN1 (0.43) MEN1KMT2A
SCHEMBL7716161 0.69 MAPT (0.36) MEN1KMT2ANPY5R
SCHEMBL3832801 0.68 ITGB1 (0.35)

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
EP-1332132-B1 ENAMINE DERIVATIVES AS CELL ADHESION MOLECULES UCB PHARMA SA (BE) 2007-10-10 EP disclosed
US-6780874-B2 AUTOIMMUNE DISEASE; ANTIINFLAMMATORY AGENTS; ANTIPROLIFERATIVE AGENT CELLTECH R & D LIMITED (GB) 2004-08-24 US disclosed
US-20030229116-A1 ENAMINE DERIVATIVES UCB PHARMA S.A. (BE) 2003-12-11 US disclosed
US-6610700-B2 Inhibit binding of integrins to their ligands, use in immune or inflammatory disorders; 3-(4-((2,6-Naphthyridinyl)amino)-phenyl)-2-((2-(1-ethylpropyl)-3-oxo-1 -cyclopentenyl) amino)-propionic acid, for example CELLTECH R & D LIMITED (GB) 2003-08-26 US disclosed
US-20020037909-A1 Enamine derivatives UCB PHARMA S.A. (BE) 2002-03-28 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 (2 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-20020037909-A1 Enamine derivatives CCR1, ITGB2, CCR10 PRMT3 1065/4885IGF1R 131/4885MEN1 4755/4885
US-20030229116-A1 ENAMINE DERIVATIVES ITGB2, CCR1, CCR10 PRMT3 1056/4885IGF1R 135/4885MEN1 4761/4885

“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.