SCHEMBL14633899

SCHEMBL14633899

Cc1ccccc1N1CCN(c2ccc(C(=O)NCc3ccc(Cl)cc3)cc2C(N)=O)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FSHR P23945 1/20 0.54
PPARG P37231 1/20 0.48
CXCR3 P49682 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
NPC1 O15118 1/20 0.46
KMT2A Q03164 1/20 0.46
DRD2 P14416 3/20 0.46
DRD3 P35462 3/20 0.46
DRD4 P21917 1/20 0.46
ADRA1A P35348 1/20 0.46
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL14633900 0.88 FSHR (0.51) FSHRCXCR3SMN1; SMN2HTTNPSR1
SCHEMBL14633476 0.88 FSHR (0.52) FSHRPPARGKMT2ADRD2DRD3
SCHEMBL14633946 0.86 FSHR (0.54) FSHRSMN1; SMN2KMT2ADRD2DRD3
SCHEMBL14634120 0.85 FSHR (0.53) FSHRNPC1KMT2ADRD2DRD3
SCHEMBL14634004 0.84 FSHR (0.54) FSHRHTTNPSR1DRD2DRD3
SCHEMBL14634030 0.83 FSHR (0.57) FSHRKMT2ADRD2DRD3DRD4
SCHEMBL14634060 0.83 FSHR (0.53) FSHRPPARGDRD2DRD3DRD4
SCHEMBL14633912 0.82 DRD2 (0.53) FSHRDRD2DRD3DRD4ADRA1A
SCHEMBL14634037 0.81 DRD2 (0.57) FSHRDRD2DRD3DRD4ADRA1A
SCHEMBL14634002 0.81 DRD2 (0.57) FSHRDRD2DRD3DRD4ADRA1A

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-9938262-B2 Benzamides MERCK PATENT GMBH (DE) 2018-04-10 US disclosed
EP-3263568-A1 BENZAMIDES Merck Patent GmbH (DE) 2018-01-03 EP disclosed
EP-2734517-B1 BENZAMIDES MERCK PATENT GMBH (DE) 2017-08-30 EP disclosed
US-20170022191-A1 BENZAMIDES MERCK PATENT GMBH (DE) 2017-01-26 US disclosed
US-9498475-B2 Benzamides MERCK PATENT GMBH (DE) 2016-11-22 US disclosed
US-20160022670-A1 BENZAMIDES MERCK PATENT GMBH (DE) 2016-01-28 US disclosed
US-9181226-B2 Benzamides MERCK PATENT GMBH (DE) 2015-11-10 US disclosed
EP-2734517-A1 BENZAMIDES Merck Patent GmbH (DE) 2014-05-28 EP disclosed
WO-2013012848-A1 BENZAMIDES MERCK PATENT GMBH (DE) 2013-01-24 WO disclosed
US-20130023522-A1 BENZAMIDES MERCK PATENT GMBH (DE) 2013-01-24 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 (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-20160022670-A1 BENZAMIDES FSHR, GNRHR, LHCGR FSHR 1/4885PPARG 245/4885CXCR3 4544/4885
US-20170022191-A1 BENZAMIDES FSHR, GNRHR, LHCGR FSHR 1/4885PPARG 245/4885CXCR3 4544/4885
US-20130023522-A1 BENZAMIDES FSHR, GNRHR, LHCGR FSHR 1/4885PPARG 328/4885CXCR3 4346/4885

“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.