SCHEMBL2385194

SCHEMBL2385194

CCc1cccc(NC(=O)N2CCN(c3nc(C)ccc3OCc3ccnc(N)n3)CC2)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 1/20 0.43
P2RY12 Q9H244 7/20 0.43
PDGFRB P09619 5/20 0.42
LIMK2 P53671 3/20 0.41
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL2383496 0.91 P2RY12 (0.44) PI4KBP2RY12PDGFRBMAPTMAPK1
SCHEMBL2385769 0.90 PDGFRB (0.44) PI4KBP2RY12PDGFRBLIMK2MAPT
SCHEMBL2384210 0.86 PI4KB (0.43) PI4KBP2RY12PDGFRBLIMK2MAPT
SCHEMBL2384230 0.86 MAPT (0.55) PI4KBMAPTMAPK1L3MBTL1
SCHEMBL2381564 0.86 P2RY12 (0.45) PI4KBP2RY12PDGFRBLIMK2
SCHEMBL2384924 0.85 PI4KB (0.44) PI4KBP2RY12PDGFRBLIMK2MAPT
SCHEMBL2716171 0.84 PDGFRB (0.45) PI4KBPDGFRBLIMK2MAPTMAPK1
SCHEMBL2384868 0.84 PDGFRB (0.45) PDGFRBMAPT
SCHEMBL2385316 0.83 NR2E1 (0.47) MAPT
SCHEMBL2717511 0.82 PI4KB (0.53) PI4KBP2RY12LIMK2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US claimed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US claimed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 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-20070275952-A1 Tie-2 Modulators and Methods of Use TIE1, TEK, KDR PI4KB 213/4885P2RY12 1298/4885PDGFRB 45/4885

“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.