SCHEMBL3892883

SCHEMBL3892883

CCC(Oc1ccccc1O)N1CCC(O)CC1c1ccc(-c2cccc(F)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 5/20 0.36
MAOB P27338 6/20 0.35
MAOA P21397 4/20 0.35
KDM1A O60341 1/20 0.35
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
FYN P06241 1/20 0.32
ESR2 Q92731 1/20 0.32
MCHR1 Q99705 1/20 0.31
HTR2C P28335 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
PRCP P42785 1/20 0.31

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
SCHEMBL3892468 0.77 MAOB (0.36) MAOBMAOAALDH1A1
SCHEMBL3034824 0.70 DRD2 (0.47) PAX8MAOBMAOAKDM1ADRD2
SCHEMBL6162681 0.69 OPRL1 (0.37) DRD2
SCHEMBL3894111 0.68 GRIN2B (0.46) PAX8MAOBMAOAKDM1ADRD2
SCHEMBL3892760 0.67 RIPK1 (0.43) PAX8MAOBMAOAKDM1APRCP
SCHEMBL3890565 0.66 LMNA (0.40) PAX8MAOBMAOAKDM1ADRD2
SCHEMBL3892356 0.66 DRD2 (0.33) DRD2DRD4FYNESR2MCHR1
SCHEMBL3892649 0.66 HRH3 (0.35) DRD2MCHR1KDM4EALDH1A1
SCHEMBL3899665 0.66 PAX8 (0.42) PAX8MAOBMAOAKDM1AALDH1A1
SCHEMBL8220687 0.64 SLC18A3 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7498344-B2 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same ASUBIO PHARMA CO., LTD. (JP) 2009-03-03 US disclosed
EP-0867183-B1 ARYLPIPERIDINOL AND ARYLPIPERIDINE DERIVATIVES AND DRUGS CONTAINING THE SAME DAIICHI SUNTORY PHARMA CO LTD (JP) 2004-10-06 EP disclosed
US-20040186138-A1 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same DAIICHI SUNTORY PHARMA CO., LTD. 2004-09-23 US disclosed
US-6706734-B2 ANTIISCHEMIC AGENTS; ANTICONVULSANTS; HEADACHES DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2004-03-16 US disclosed
US-20030130312-A1 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same ASUBIO PHARMA CO., LTD. (JP) 2003-07-10 US disclosed
US-6455549-B1 ANTIEPILEPTIC, ANTIISCHEMIC, AND ANTIMIGRAINE AGENTS; CALCIUM OVELOAD SUPPRESSANTS SUNTORY LIMITED (JP) 2002-09-24 US disclosed
EP-0867183-A1 ARYLPIPERIDINOL AND ARYLPIPERIDINE DERIVATIVES AND DRUGS CONTAINING THE SAME SUNTORY LIMITED (JP) 1998-09-30 EP 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-20030130312-A1 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same KCNH1, KCNH2, NPY1R PAX8 2609/4885MAOB 86/4885MAOA 56/4885
US-20040186138-A1 Arylpiperidinol and arylpiperidine derivatives and pharmaceuticals containing the same KCNH1, KCNH2, NPY1R PAX8 2609/4885MAOB 86/4885MAOA 56/4885

“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.