SCHEMBL4566835

SCHEMBL4566835

Cc1ccc(N)c(N2CCN(C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMARCA2 P51531 1/20 0.54
SMARCA4 P51532 1/20 0.54
PBRM1 Q86U86 1/20 0.54
MAPT P10636 3/20 0.51
GPR119 Q8TDV5 3/20 0.51
LMNA P02545 3/20 0.51
ALDH1A1 P00352 1/20 0.51
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
CYP2C19 P33261 1/20 0.48
MAP4K4 O95819 1/20 0.46
TSHR P16473 2/20 0.46
NR1H2 P55055 1/20 0.45
GAA P10253 1/20 0.44
ALOX12 P18054 1/20 0.44
MC4R P32245 1/20 0.43
KIT P10721 1/20 0.43

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
SCHEMBL4439841 0.89 SMARCA2 (0.54) SMARCA2SMARCA4PBRM1MAPTGPR119
SCHEMBL12516958 0.86 SMARCA2 (0.57) SMARCA2SMARCA4PBRM1MAPTGPR119
SCHEMBL955402 0.85 NR1H4 (0.55) SMARCA2SMARCA4PBRM1MAPTLMNA
SCHEMBL15071214 0.83 MAPT (0.54) SMARCA2SMARCA4PBRM1MAPTGPR119
SCHEMBL27796424 0.83 SMARCA2 (0.51) SMARCA2SMARCA4PBRM1MAPTGPR119
SCHEMBL11414381 0.82 MAPT (0.52) SMARCA2SMARCA4PBRM1MAPTGPR119
SCHEMBL2366297 0.82 GPR119 (0.52) SMARCA2SMARCA4PBRM1MAPTGPR119
SCHEMBL23293364 0.82 MAPT (0.61) SMARCA2SMARCA4PBRM1MAPTGPR119
SCHEMBL31157974 0.82 MAPT (0.61) SMARCA2SMARCA4PBRM1MAPTGPR119
SCHEMBL2843440 0.82 SMARCA2 (0.60) SMARCA2SMARCA4PBRM1MAPTGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2014-09-04 US disclosed
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2014-09-04 US disclosed
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2014-09-04 US disclosed
US-8822497-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-02 US disclosed
US-8822497-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-02 US disclosed
US-8822497-B2 PIM kinase inhibitors and methods of their use NOVARTIS AG (CH) 2014-09-02 US disclosed
EP-2132177-B1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2013-07-17 EP disclosed
EP-2132177-B1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2013-07-17 EP disclosed
US-20130164259-A1 1,4-SUBSTITUTED PIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION 2013-06-27 US disclosed
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-16 US disclosed
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-16 US disclosed
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS AG (CH) 2012-08-16 US disclosed
EP-2132177-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE Novartis Ag (CH) 2009-12-16 EP disclosed
WO-2008106692-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-09-04 WO disclosed
WO-2008106692-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-09-04 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 (3 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-20130164259-A1 1,4-SUBSTITUTED PIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF ZC3HAV1, BAZ2A, HAVCR2 SMARCA2 4319/4885SMARCA4 3594/4885PBRM1 180/4885
US-20140249135-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 SMARCA2 1455/4885SMARCA4 1579/4885PBRM1 607/4885
US-20120208815-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE PIM1, PIM2, PIM3 SMARCA2 1455/4885SMARCA4 1579/4885PBRM1 607/4885

“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.