SCHEMBL4151572

SCHEMBL4151572

COc1ccccc1CCCC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.53
KDM4E B2RXH2 1/20 0.52
PKM P14618 1/20 0.52
GPR119 Q8TDV5 6/20 0.51
BCHE P06276 3/20 0.51
ACHE P22303 3/20 0.51
FAAH O00519 1/20 0.47
P2RX3 P56373 1/20 0.47

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
SCHEMBL4152000 0.88 KDM4E (0.49) TGFBR1KDM4EPKMGPR119FAAH
SCHEMBL23119230 0.87 KDM4E (0.55) TGFBR1KDM4EPKMGPR119BCHE
SCHEMBL4151836 0.87 PDE4D (0.50) TGFBR1KDM4EPKMGPR119FAAH
SCHEMBL8233089 0.86 KDM4E (0.54) KDM4EPKMGPR119FAAH
SCHEMBL7984274 0.84 KDM4E (0.53) TGFBR1KDM4EPKMGPR119FAAH
SCHEMBL7413655 0.83 GPR119 (0.57) TGFBR1KDM4EPKMGPR119FAAH
SCHEMBL4144200 0.82 GPR119 (0.51) KDM4EPKMGPR119FAAH
SCHEMBL13913655 0.82 KDM4E (0.60) KDM4EPKMGPR119FAAH
SCHEMBL27406184 0.80 SCN9A (0.50) BCHEP2RX3
SCHEMBL791854 0.80 KDM4E (0.55) TGFBR1KDM4EPKMGPR119

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
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 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-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators GRM1, GRIN1, GRM2 TGFBR1 953/4885KDM4E 3143/4885PKM 1055/4885

“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.