SCHEMBL15568626

SCHEMBL15568626

Cn1ccnc1C(O)(c1ccccc1)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 7/20 0.49
GPR119 Q8TDV5 5/20 0.48
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
USP30 Q70CQ3 1/20 0.43
MEN1 O00255 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
SCHEMBL14115107 0.88 GPR119 (0.52) NPY2RGPR119KMT2AKDM4EPKM
SCHEMBL239883 0.84 NPY2R (0.65) NPY2RGPR119KMT2AALDH1A1KDM4E
SCHEMBL22491552 0.78 MEN1 (0.60) NPY2RGPR119KMT2AALDH1A1KDM4E
SCHEMBL22773246 0.78 MEN1 (0.60) NPY2RGPR119KMT2AALDH1A1KDM4E
SCHEMBL3655794 0.78 NPY2R (0.58) NPY2RGPR119KMT2AALDH1A1KDM4E
SCHEMBL23212017 0.78 NPY2R (0.50) NPY2RGPR119ALDH1A1KDM4EPKM
SCHEMBL30568007 0.78 NPY2R (0.50) NPY2RGPR119ALDH1A1KDM4EPKM
SCHEMBL3659737 0.77 GPR119 (0.61) NPY2RGPR119KMT2AKDM4EPKM
SCHEMBL16932529 0.76 NPY2R (0.48) NPY2RGPR119KMT2AALDH1A1KDM4E
SCHEMBL15568941 0.76 HRH1 (0.60) KMT2AALDH1A1KDM4EPKMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9505752-B2 Piperidine amide derivatives as HIV attachment inhibitors VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2016-11-29 US disclosed
US-9505752-B2 Piperidine amide derivatives as HIV attachment inhibitors VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2016-11-29 US disclosed
US-9505752-B2 Piperidine amide derivatives as HIV attachment inhibitors VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2016-11-29 US disclosed
EP-2895471-B1 PIPERIDINE AMIDE DERIVATIVES AS HIV ATTACHMENT INHIBITORS VIIV HEALTHCARE UK NO 5 LTD (GB) 2016-11-23 EP disclosed
EP-2895471-B1 PIPERIDINE AMIDE DERIVATIVES AS HIV ATTACHMENT INHIBITORS VIIV HEALTHCARE UK NO 5 LTD (GB) 2016-11-23 EP disclosed
US-20150210684-A1 PIPERIDINE AMIDE DERIVATIVES AS HIV ATTACHMENT INHIBITORS VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2015-07-30 US disclosed
US-20150210684-A1 PIPERIDINE AMIDE DERIVATIVES AS HIV ATTACHMENT INHIBITORS VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2015-07-30 US disclosed
US-20150210684-A1 PIPERIDINE AMIDE DERIVATIVES AS HIV ATTACHMENT INHIBITORS VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2015-07-30 US disclosed
EP-2895471-A1 PIPERIDINE AMIDE DERIVATIVES AS HIV ATTACHMENT INHIBITORS Bristol-Myers Squibb Company (US) 2015-07-22 EP disclosed
WO-2014025854-A1 PIPERIDINE AMIDE DERIVATIVES AS HIV ATTACHMENT INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-02-13 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-20150210684-A1 PIPERIDINE AMIDE DERIVATIVES AS HIV ATTACHMENT INHIBITORS CD4, HDAC5, ITGA5 NPY2R 4809/4885GPR119 3381/4885KMT2A 1503/4885

“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.