SCHEMBL4374264

SCHEMBL4374264

COc1ccc2c(=O)cc[nH]c2c1OC1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR8 P51685 1/20 0.44
KMT2A Q03164 1/20 0.42
PDE4A P27815 8/20 0.42
PDE4B Q07343 14/20 0.42
PDE4D Q08499 7/20 0.42
PDE4C Q08493 6/20 0.42
VEGFA P15692 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
SCHEMBL9700936 0.81 CCR8 (0.57) CCR8KMT2A
SCHEMBL4365693 0.80 JAK2 (0.46) PDE4APDE4BPDE4DPDE4CVEGFA
SCHEMBL4369467 0.74 PDE4B (0.53) KMT2APDE4APDE4BPDE4DPDE4C
SCHEMBL728672 0.73 CYP19A1 (0.50) KMT2APDE4APDE4BPDE4DPDE4C
SCHEMBL730919 0.73 CYP19A1 (0.50) KMT2APDE4APDE4BPDE4DPDE4C
SCHEMBL7385897 0.73 PDE4B (0.49) PDE4APDE4BPDE4DPDE4C
SCHEMBL4366172 0.72 PDE4B (0.51) PDE4APDE4BPDE4DPDE4CVEGFA
SCHEMBL19890539 0.71 CCR8 (0.55) CCR8KMT2A
SCHEMBL7283419 0.71 CCR8 (0.55) CCR8KMT2A
SCHEMBL30940174 0.71 CCR8 (0.55) CCR8KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090291950-A1 BICYCLIC HETEROARYL INHIBITORS OF PDE4 KALYPSYS, INC. (US) 2009-11-26 US disclosed
WO-2008006052-A2 BICYCLIC HETEROARYL INHIBITORS OF PDE4 GOVEK STEVEN P (US) 2008-01-10 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-20090291950-A1 BICYCLIC HETEROARYL INHIBITORS OF PDE4 PDE4A, PDE4B, PDE4C CCR8 298/4885KMT2A 3155/4885PDE4A 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.