SCHEMBL3545211

SCHEMBL3545211

O=C(O)CC1CCC(c2ccc(NC(=O)OCc3ccccc3)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.60
MAOA P21397 2/20 0.60
MAOB P27338 2/20 0.60
RCOR1 Q9UKL0 2/20 0.59
HRH3 Q9Y5N1 2/20 0.57
POLB P06746 1/20 0.52
IDO1 P14902 1/20 0.52
MGLL Q99685 1/20 0.50
TP53 P04637 1/20 0.49
MAPT P10636 1/20 0.49
DGAT1 O75907 2/20 0.48

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
SCHEMBL3545210 1.00 KDM1A (0.60) KDM1AMAOAMAOBRCOR1HRH3
SCHEMBL13009665 0.90 KDM1A (0.57) KDM1AMAOAMAOBRCOR1HRH3
SCHEMBL28697724 0.83 KDM1A (0.62) KDM1AMAOAMAOBRCOR1HRH3
SCHEMBL2635332 0.82 KDM1A (0.65) KDM1AMAOAMAOBRCOR1HRH3
SCHEMBL2635334 0.82 KDM1A (0.65) KDM1AMAOAMAOBRCOR1HRH3
SCHEMBL2635331 0.82 KDM1A (0.65) KDM1AMAOAMAOBRCOR1HRH3
SCHEMBL3297347 0.81 IDO1 (0.60) IDO1DGAT1
SCHEMBL3297351 0.81 IDO1 (0.60) IDO1DGAT1
SCHEMBL13009667 0.81 HRH3 (0.52) KDM1AMAOAMAOBRCOR1HRH3
SCHEMBL24890394 0.80 KDM1A (0.55) KDM1AMAOAMAOBRCOR1HRH3

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-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2010-12-16 US disclosed
US-7795283-B2 Oxadiazole derivative as DGAT inhibitors ASTRAZENECA AB (SE) 2010-09-14 US disclosed
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors ASTRAZENECA AB (SE) 2008-04-24 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-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS DGAT1, DGAT2, GPR119 KDM1A 3388/4885MAOA 1483/4885MAOB 1003/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 KDM1A 3013/4885MAOA 1463/4885MAOB 1013/4885

“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.