SCHEMBL3023252

SCHEMBL3023252

O=Cc1ccc(-c2cccc(-n3c(=O)n([C@H]4CC[C@@H](NC(=O)O)CC4)c(=O)c4cc(F)cnc43)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.35
FGFR3 P22607 1/20 0.35
KDR P35968 1/20 0.35
PDE4B Q07343 13/20 0.35
PDE4D Q08499 13/20 0.35
PDE4A P27815 11/20 0.35
PDE4C Q08493 11/20 0.35
MAP4K4 O95819 1/20 0.35
CNR2 P34972 1/20 0.33
TNF P01375 1/20 0.32
LITAF Q99732 1/20 0.32

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
SCHEMBL3023254 1.00 KCNH2 (0.35) KCNH2FGFR3KDRPDE4BPDE4D
SCHEMBL4233040 0.91 PDE4B (0.36) KCNH2PDE4BPDE4DPDE4APDE4C
SCHEMBL4233037 0.91 PDE4B (0.36) KCNH2PDE4BPDE4DPDE4APDE4C
SCHEMBL3027613 0.90 GRIN1 (0.33) KCNH2PDE4BPDE4DPDE4APDE4C
SCHEMBL3027610 0.90 GRIN1 (0.33) KCNH2PDE4BPDE4DPDE4APDE4C
SCHEMBL10271512 0.89 JAK1 (0.37) KCNH2PDE4BPDE4DPDE4APDE4C
SCHEMBL870527 0.89 PDE4B (0.45) KCNH2PDE4BMAP4K4CNR2
SCHEMBL870526 0.89 PDE4B (0.45) KCNH2PDE4BMAP4K4CNR2
SCHEMBL3029124 0.88 CNR2 (0.33) KCNH2FGFR3KDRPDE4BPDE4D
SCHEMBL871632 0.88 CNR2 (0.33) KCNH2FGFR3KDRPDE4BPDE4D

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
EP-2106396-B1 CHEMICAL COMPOUNDS 637: PYRIDOPYRIMIDINEDIONES AS PDE4 INHIBITORS ALCON RES LTD (US) 2014-09-24 EP disclosed
US-20100204203-A1 Chemical Compounds 637: Pyridopyrimidinediones as PDE4 Inhibitors ALCON RESEARCH, LTD. 2010-08-12 US disclosed
US-20090124596-A1 Chemical Compounds 637 ALCON RESEARCH, LTD. 2009-05-14 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-20090124596-A1 Chemical Compounds 637 PDE4A, PDE4B, PDE3B KCNH2 3141/4885FGFR3 2966/4885KDR 3013/4885
US-20100204203-A1 Chemical Compounds 637: Pyridopyrimidinediones as PDE4 Inhibitors PDE4A, PDE4B, PDE5A KCNH2 3031/4885FGFR3 2248/4885KDR 1983/4885

“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.