SCHEMBL1382035

SCHEMBL1382035

O=C(C=Cc1ccc(C(=O)N2CCC(N3CCCC3)CC2)cc1)c1ccc2ccccc2n1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 18/20 0.56
L3MBTL1 Q9Y468 16/20 0.56
MBTD1 Q05BQ5 6/20 0.53
TP53BP1 Q12888 2/20 0.53
L3MBTL4 Q8NA19 2/20 0.53
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL1385625 0.90 ALDH1A1 (0.47) KDM4EALDH1A1
SCHEMBL1383374 0.89 HPGD (0.49) KDM4EALDH1A1
SCHEMBL1383236 0.84 HPGD (0.48)
SCHEMBL1382038 0.84 PFKFB3 (0.57) L3MBTL3L3MBTL1MBTD1TP53BP1L3MBTL4
SCHEMBL1383235 0.83 SIGMAR1 (0.52) L3MBTL1KDM4EALDH1A1
SCHEMBL1382600 0.83 SMN1; SMN2 (0.50) L3MBTL1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL1383574 0.83 TSHR (0.45) KDM4EALDH1A1
SCHEMBL1386472 0.83 TSHR (0.47) KDM4EALDH1A1
SCHEMBL1383929 0.83 TSHR (0.51) KDM4EALDH1A1
SCHEMBL5093494 0.81 FASN (0.56) KDM4EALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4790704-B2 2011-10-12 JP claimed
US-20080207608-A1 2-Propene-1-Ones As Hsp 70 Inducers TORRENT PHARMACEUTICALS LTD. (IN) 2008-08-28 US claimed
EP-1748987-A2 2-PROPENE-1-ONES AS HSP 70 INDUCERS Torrent Pharmaceuticals Ltd (IN) 2007-02-07 EP claimed
WO-2005097746-A2 2-PROPENE-1-ONES AS HSP 70 INDUCERS TORRENT PHARMACEUTICALS LTD (IN) 2005-10-20 WO claimed
US-20080207608-A1 2-Propene-1-Ones As Hsp 70 Inducers TORRENT PHARMACEUTICALS LTD. (IN) 2008-08-28 US disclosed
EP-1748987-A2 2-PROPENE-1-ONES AS HSP 70 INDUCERS Torrent Pharmaceuticals Ltd (IN) 2007-02-07 EP disclosed
WO-2005097746-A2 2-PROPENE-1-ONES AS HSP 70 INDUCERS TORRENT PHARMACEUTICALS LTD (IN) 2005-10-20 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-20080207608-A1 2-Propene-1-Ones As Hsp 70 Inducers HSPB1, HSF1, HSPE1 L3MBTL3 2003/4885L3MBTL1 1433/4885MBTD1 4401/4885

“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.