SCHEMBL759155

SCHEMBL759155

CN(C)C(=O)c1ccc2c(n1)CCN2C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.39
GPR119 Q8TDV5 7/20 0.37
CNR2 P34972 1/20 0.36
MPO P05164 1/20 0.36
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
IDO1 P14902 3/20 0.34
CHRM4 P08173 1/20 0.34
DRD2 P14416 1/20 0.34
HTR7 P34969 1/20 0.34
MAPT P10636 2/20 0.34
GRM5 P41594 1/20 0.34
KCNH2 Q12809 1/20 0.34
UCHL1 P09936 1/20 0.33

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
SCHEMBL299875 0.86 KDM1A (0.39) KDM1AGPR119MPOHDAC1HDAC6
SCHEMBL758592 0.84 HDAC1 (0.44) KDM1AGPR119MPOHDAC1HDAC6
SCHEMBL288301 0.82 KDM4A (0.38) CNR2IDO1KCNH2
SCHEMBL29173113 0.81 KDM1A (0.43) KDM1AGPR119MPOHDAC1HDAC6
SCHEMBL22397607 0.80 UCHL1 (0.40) KDM1AGPR119MPOHDAC1HDAC6
SCHEMBL27061519 0.80 MPO (0.44) KDM1AGPR119MPOHDAC1HDAC6
SCHEMBL13568076 0.80 ESR2 (0.47) GPR119MAPTGRM5
SCHEMBL22397739 0.79 MPO (0.42) KDM1AGPR119MPOHDAC1HDAC6
SCHEMBL27437947 0.79 CHRM4 (0.40) KDM1AGPR119MPOHDAC1HDAC6
SCHEMBL20572183 0.77 IDO1 (0.44) KDM1AGPR119MPOHDAC1HDAC6

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-20120052130-A1 GPR 119 MODULATORS PFIZER INC. 2012-03-01 US disclosed
US-20100285145-A1 GPR 119 MODULATORS PFIZER INC 2010-11-11 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-20120052130-A1 GPR 119 MODULATORS GPR119, GPR39, GPR65 KDM1A 3691/4885GPR119 1/4885CNR2 199/4885
US-20100285145-A1 GPR 119 MODULATORS GPR119, GPR65, GPR39 KDM1A 3574/4885GPR119 1/4885CNR2 138/4885

“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.