SCHEMBL3211537

SCHEMBL3211537

COc1ccc(N(Cc2cccc(F)c2)c2cccc(C(=O)OC(C)(C)C)c2)cc1OC1CCCC1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 13/20 0.45
PDE4D Q08499 8/20 0.45
PDE4A P27815 7/20 0.45
PDE4C Q08493 6/20 0.45
LPAR1 Q92633 1/20 0.45
LPAR5 Q9H1C0 1/20 0.45
POLB P06746 1/20 0.40
EPHX2 P34913 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
SCHEMBL3129713 0.98 LPAR1 (0.45) PDE4BPDE4DPDE4APDE4CLPAR1
SCHEMBL3128234 0.95 PDE4B (0.42) PDE4BPDE4DPDE4APDE4CLPAR1
SCHEMBL3125476 0.90 QPCT (0.42) LPAR1LPAR5POLB
SCHEMBL3214547 0.89 PDE4A (0.58) PDE4BPDE4DPDE4APDE4CLPAR1
SCHEMBL3192935 0.87 PDE4A (0.56) PDE4BPDE4DPDE4APDE4CLPAR1
SCHEMBL4193004 0.87 PDE4A (0.52) PDE4BPDE4DPDE4APDE4C
SCHEMBL3205063 0.86 PDE4B (0.46) PDE4BPDE4DPDE4APDE4CEPHX2
SCHEMBL3131007 0.85 KMT2A (0.45) LPAR1LPAR5POLB
SCHEMBL3205698 0.85 PDE4B (0.44) PDE4BPDE4DPDE4APDE4C
SCHEMBL3131424 0.85 PDE4B (0.43) PDE4BPDE4DPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-02-04 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-20100029689-A1 PHOSPHODIESTERASE 4 INHIBITORS PDE4A, PDE4B, PDE3B PDE4B 2/4885PDE4D 9/4885PDE4A 1/4885

“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.