SCHEMBL1383374

SCHEMBL1383374

O=C(C=Cc1ccc(C(=O)N2CCCCC2)cc1)c1ccc2ccccc2n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.49
APP P05067 2/20 0.47
ALDH1A1 P00352 4/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 1/20 0.46
GRIN2B Q13224 1/20 0.46
GPR183 P32249 1/20 0.46
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
PTK2 Q05397 1/20 0.44
MAPK1 P28482 3/20 0.44
RAB9A P51151 2/20 0.44
CYSLTR2 Q9NS75 1/20 0.43
CYSLTR1 Q9Y271 1/20 0.43
CNR2 P34972 1/20 0.43
FASN P49327 1/20 0.43
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42

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 0.99 ALDH1A1 (0.47) HPGDAPPALDH1A1GAATSHR
SCHEMBL1383235 0.90 SIGMAR1 (0.52) ALDH1A1GAATSHRGPR183SMN1; SMN2
SCHEMBL1383929 0.89 TSHR (0.51) HPGDAPPALDH1A1GAATSHR
SCHEMBL1386472 0.89 TSHR (0.47) APPALDH1A1GAATSHRGRIN2B
SCHEMBL1382600 0.89 SMN1; SMN2 (0.50) HPGDAPPALDH1A1TSHRGPR183
SCHEMBL1383574 0.89 TSHR (0.45) HPGDALDH1A1GAATSHRGRIN2B
SCHEMBL1382035 0.89 L3MBTL3 (0.56) ALDH1A1KDM4E
SCHEMBL1384986 0.86 GRIN2B (0.47) ALDH1A1GAATSHRGRIN2BGPR183
SCHEMBL1383236 0.84 HPGD (0.48) HPGDAPPGAATSHRGPR183
SCHEMBL1385464 0.84 SMN1; SMN2 (0.54) ALDH1A1GAATSHRSMN1; SMN2KDM4E

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 HPGD 314/4885APP 156/4885ALDH1A1 1129/4885

“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.