SCHEMBL5205367

SCHEMBL5205367

CN1CCN(C(=O)CC(=O)Nc2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.66
SMN1; SMN2 Q16637 2/20 0.63
HTT P42858 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.59
EPHX2 P34913 2/20 0.55
MAPT P10636 4/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
GAA P10253 1/20 0.55
XBP1 P17861 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
ALDH1A1 P00352 3/20 0.55
RAB9A P51151 1/20 0.53
KDM4E B2RXH2 2/20 0.53
POLB P06746 2/20 0.53
HDAC3 O15379 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51

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
SCHEMBL5202299 0.89 RAB9A (0.67) LMNASMN1; SMN2L3MBTL1EPHX2MAPT
SCHEMBL5208545 0.85 LMNA (0.63) LMNAEPHX2MAPTMEN1KMT2A
SCHEMBL4302538 0.85 LMNA (0.72) LMNASMN1; SMN2HTTEPHX2MAPT
SCHEMBL5239760 0.81 DPP4 (0.56) LMNASMN1; SMN2HTTL3MBTL1EPHX2
SCHEMBL31236338 0.80 MAPT (0.77) SMN1; SMN2HTTL3MBTL1MAPTMEN1
SCHEMBL5142590 0.80 MAPT (0.77) SMN1; SMN2HTTL3MBTL1MAPTMEN1
SCHEMBL14119767 0.80 LMNA (1.00) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL30212894 0.77 SMN1; SMN2 (0.69) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL9429509 0.77 SMN1; SMN2 (0.69) LMNASMN1; SMN2HTTL3MBTL1MAPT
SCHEMBL10576190 0.77 MEN1 (0.78) LMNASMN1; SMN2HTTEPHX2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1554246-B1 DIHYDROPYRIDINONE DERIVATIVES AS HNE INHIBITORS BAYER HEALTHCARE AG (DE) 2007-08-22 EP disclosed
EP-1554246-B1 DIHYDROPYRIDINONE DERIVATIVES AS HNE INHIBITORS BAYER HEALTHCARE AG (DE) 2007-08-22 EP disclosed
US-7230017-B2 Dihydropyridinone derivatives BAYER HEALTHCARE AG (DE) 2007-06-12 US disclosed
US-7230017-B2 Dihydropyridinone derivatives BAYER HEALTHCARE AG (DE) 2007-06-12 US disclosed
US-7230017-B2 Dihydropyridinone derivatives BAYER HEALTHCARE AG (DE) 2007-06-12 US disclosed
US-20060100207-A1 Dihydropyridinone derivatives BAYER HEALTHCARE AG (DE) 2006-05-11 US disclosed
EP-1554246-A2 DIHYDROPYRIDINONE DERIVATIVES AS HNE INHIBITORS Bayer HealthCare AG (DE) 2005-07-20 EP disclosed
WO-2004020410-A2 DIHYDROPYRIDINONE DERIVATIVES AS HNE INHIBITORS BAYER HEALTHCARE AG (DE) 2004-03-11 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-20060100207-A1 Dihydropyridinone derivatives TNNI3, DHPS, TNNT2 LMNA 2783/4885SMN1; SMN2 4108/4885HTT 4647/4885

“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.