SCHEMBL5111664

SCHEMBL5111664

O=C(NC1(C(=O)O)CCCCC1)c1cc2cc(OCCN3CCCC3)ccc2o1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.49
TACR2 P21452 1/20 0.46
KDM4E B2RXH2 5/20 0.45
POLB P06746 2/20 0.45
TSHR P16473 1/20 0.45
ATF4 P18848 1/20 0.44
ADAM17 P78536 3/20 0.44
SIGMAR1 Q99720 2/20 0.43
MCHR1 Q99705 1/20 0.42
PSMB1 P20618 1/20 0.42
PSMB5 P28074 1/20 0.42
PSMB2 P49721 1/20 0.42
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL5104760 1.00 MAOB (0.49) MAOBTACR2KDM4EPOLBTSHR
SCHEMBL5101810 0.94 TACR2 (0.49) MAOBTACR2KDM4ETSHRATF4
SCHEMBL6912913 0.86 MAOB (0.48) MAOBKDM4EPOLBTSHRATF4
SCHEMBL6912921 0.86 MAOB (0.48) MAOBKDM4EPOLBTSHRATF4
SCHEMBL4763329 0.83 MAOB (0.57) MAOBKDM4EPOLBTSHRSIGMAR1
SCHEMBL443699 0.81 MAOB (0.55) MAOBKDM4EPOLBTSHRSIGMAR1
SCHEMBL1812570 0.80 PSMB1 (0.61) KDM4EPSMB1PSMB5PSMB2
SCHEMBL1807911 0.80 PSMB1 (0.61) KDM4EPSMB1PSMB5PSMB2
SCHEMBL445130 0.79 KDM4E (0.55) MAOBKDM4ETSHRADAM17SIGMAR1
SCHEMBL14383957 0.76 TSHR (0.53) MAOBKDM4ETSHRADAM17DRD2

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-7342027-B2 1-phenylpiperidin-3-one derivatives and processes for the preparation thereof YUHAN CORPORATION (KR) 2008-03-11 US disclosed
US-20050234057-A1 1-Phenylpiperidin-3-one derivatives and processes for the preparation thereof DONG-A PHARMACEUTICAL CO., LTD. (KR) 2005-10-20 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-20050234057-A1 1-Phenylpiperidin-3-one derivatives and processes for the preparation thereof CTRL, PRCP, CLPP MAOB 1276/4885TACR2 3647/4885KDM4E 2744/4885

“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.