SCHEMBL4195745

SCHEMBL4195745

CC(C)(C)OC(=O)N1CCC(CCc2ccc3c(c2)NCC(=O)O3)CC1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.45
FAAH O00519 1/20 0.42
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
PKM P14618 1/20 0.41
TP53 P04637 1/20 0.39
STS P08842 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
SCHEMBL4179927 0.86 GRIN2D (0.37) FAAHKDM4E
SCHEMBL4182378 0.82 CYP2C9 (0.42) KDM4E
SCHEMBL4184892 0.82 GPR119 (0.45) GPR119FAAHKDM4EPKMTP53
SCHEMBL13950927 0.81 PARP1 (0.48) GPR119
SCHEMBL4192189 0.78 KDM4E (0.41) GPR119KDM4EMAPTTHRB
SCHEMBL4192185 0.78 KDM4E (0.41) GPR119KDM4EMAPTTHRB
SCHEMBL13282013 0.74 MAOB (0.53) GPR119FAAHKDM4EPKMTP53
SCHEMBL20015389 0.74 GPR119 (0.60) GPR119FAAHKDM4EPKMTP53
SCHEMBL30824890 0.74 GPR119 (0.58) GPR119FAAHKDM4EPKMTP53
SCHEMBL14783164 0.73 FAAH (0.51) GPR119FAAHKDM4EMAPTPKM

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-20090042874-A1 ANTIDEPRESSANT HETEROARYL DERIVATIVES OF HETEROCYCLE-FUSED BENZODIOXANS WYETH (US) 2009-02-12 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-20090042874-A1 ANTIDEPRESSANT HETEROARYL DERIVATIVES OF HETEROCYCLE-FUSED BENZODIOXANS HTR5A, CRH, CYP17A1 GPR119 100/4885FAAH 154/4885KDM4E 3317/4885

“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.