SCHEMBL4020144

SCHEMBL4020144

Cc1c(F)cccc1[C@H]1[C@@H](C(=O)c2cccc(O)c2)CN(CCO)C[C@@H]1C(=O)N1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.38
DPP8 Q6V1X1 4/20 0.38
MC4R P32245 2/20 0.37
MGLL Q99685 3/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
PKM P14618 1/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KDM2B Q8NHM5 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PREP P48147 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
SCHEMBL4018665 0.99 DPP4 (0.37) DPP4DPP8MC4RMGLLMAPT
SCHEMBL4019458 0.93 DPP4 (0.35) DPP4DPP8MC4RMAPTKDM4E
SCHEMBL4027949 0.92 KDM2B (0.34) MC4RMGLLMAPTKDM2BNPSR1
SCHEMBL4020633 0.92 MEN1 (0.35) MC4RMGLLKDM2B
SCHEMBL4028039 0.91 DPP4 (0.36) DPP4DPP8MC4RMGLLMAPT
SCHEMBL4778298 0.88 MC4R (0.35) DPP4DPP8MC4RMGLLMAPT
SCHEMBL4751303 0.88 KDM2B (0.33) MC4RMGLLKDM4EALDH1A1KDM2B
SCHEMBL4022700 0.88 DPP4 (0.34) DPP4DPP8MC4RMGLLMAPT
SCHEMBL4028155 0.86 KMT2A (0.34) MGLLKDM4EALDH1A1KDM2B
SCHEMBL4028057 0.86 ALDH1A1 (0.37) DPP4DPP8MC4RMGLLMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572814-B2 3,5-dibenzoyl-4-phenyl-piperidine anti-cancer compounds CYTOKINETICS, INCORPORATED (US) 2009-08-11 US disclosed
EP-1962846-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2008-09-03 EP disclosed
US-20070161674-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2007-07-12 US disclosed
WO-2007059323-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2007-05-24 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-20070161674-A1 Certain chemical entities, compositions, and methods TP53, VHL, RB1 DPP4 4285/4885DPP8 3973/4885MC4R 3874/4885

“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.