SCHEMBL5104512

SCHEMBL5104512

O=C(NC1(C(=O)O)CCCCC1)c1ccc(OCCN2CCOCC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
KDM4E B2RXH2 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
GAA P10253 1/20 0.56
HRH3 Q9Y5N1 5/20 0.54
PSMB1 P20618 2/20 0.51
PSMB5 P28074 2/20 0.51
MAPT P10636 2/20 0.51
RECQL P46063 1/20 0.51
PSMB2 P49721 1/20 0.50
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
LMNA P02545 1/20 0.47
THRB P10828 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL1812570 0.91 PSMB1 (0.61) ALDH1A1KDM4EHRH3PSMB1PSMB5
SCHEMBL1807911 0.91 PSMB1 (0.61) ALDH1A1KDM4EHRH3PSMB1PSMB5
SCHEMBL5101810 0.82 TACR2 (0.49) ALDH1A1KDM4ESMN1; SMN2NPC1RAB9A
SCHEMBL991354 0.78 ALDH1A1 (0.76) ALDH1A1KDM4ESMN1; SMN2GAAHRH3
Hydrochloric Acid SCHEMBL7887532 0.76 ALDH1A1 (0.74) ALDH1A1KDM4ESMN1; SMN2GAAHRH3
SCHEMBL1976504 0.75 PLK1 (0.55) ALDH1A1KDM4ESMN1; SMN2MAPTNPC1
SCHEMBL11757768 0.75 SMN1; SMN2 (0.62) ALDH1A1KDM4ESMN1; SMN2GAAHRH3
SCHEMBL63569 0.74 SMN1; SMN2 (0.72) ALDH1A1KDM4ESMN1; SMN2GAAHRH3
SCHEMBL3366608 0.74 LTA4H (0.78) ALDH1A1KDM4ESMN1; SMN2GAAPSMB1
SCHEMBL5111664 0.74 MAOB (0.49) KDM4EGAAPSMB1PSMB5PSMB2

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-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
WO-2004011457-A1 1-PHENYLPIPERIDIN-3-ONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2004-02-05 WO 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 ALDH1A1 740/4885KDM4E 2744/4885SMN1; SMN2 4244/4885

“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.