SCHEMBL5376922

SCHEMBL5376922

COC(=O)c1ccc(OCC=C(C)C)cc1C(=O)OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.51
MAOA P21397 1/20 0.51
ALOX5 P09917 4/20 0.50
MAPT P10636 2/20 0.49
HPGD P15428 2/20 0.49
MEN1 O00255 1/20 0.49
NR1I2 O75469 1/20 0.49
LMNA P02545 1/20 0.49
PGR P06401 1/20 0.49
ADRB2 P07550 1/20 0.49
ADRB1 P08588 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
CNR1 P21554 1/20 0.49
TBXA2R P21731 1/20 0.49
SLC6A2 P23975 1/20 0.49
AGTR1 P30556 1/20 0.49
ADRA1A P35348 1/20 0.49
OPRD1 P41143 1/20 0.49
OPRK1 P41145 1/20 0.49
BLM P54132 1/20 0.49

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
SCHEMBL9225141 0.85 MEN1 (0.69) MAOBALOX5MAPTHPGDMEN1
SCHEMBL9225136 0.85 MEN1 (0.69) MAOBALOX5MAPTHPGDMEN1
SCHEMBL5376581 0.83 BLM (0.50) MAPTMEN1LMNAADRB2ADRB1
SCHEMBL5384385 0.81 MAOB (0.55) MAOBALOX5MAPTHPGDMEN1
SCHEMBL2313483 0.80 MAPT (0.64) MAPTMEN1LMNAKMT2AALDH1A1
SCHEMBL8405878 0.80 NPC1 (0.46) MAPTHPGDMEN1LMNAKMT2A
SCHEMBL5376930 0.79 MAOB (0.48) MAOBALOX5MAPTHPGDMEN1
SCHEMBL21543853 0.79 TDP1 (0.55) MAPTMEN1LMNAKMT2AKDM4E
SCHEMBL3901893 0.78 ALOX5 (0.58) MAOBALOX5MAPTHPGDMEN1
SCHEMBL4653544 0.78 MAOB (0.64) MAOBMAOAMAPTHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7220777-B2 Lactam derivatives as antagonists for human 11cby receptors SMITHKLINE BEECHAM P.L.C. (GB) 2007-05-22 US disclosed
EP-1436267-B1 LACTAM DERIVATIVES AS ANTAGONISTS FOR HUMAN 11CBY RECEPTORS SMITHKLINE BEECHAM PLC (GB) 2006-12-27 EP disclosed
US-20060287321-A1 Novel Lactam Derivatives SMITHKLINE BEECHAM P.L.C. (GB) 2006-12-21 US disclosed
US-20050059651-A1 Lactam derivatives as antagonists for human 11cby receptors SMITHKLINE BEECHAM P.L.C. (GB) 2005-03-17 US disclosed
EP-1436267-A1 LACTAM DERIVATIVES AS ANTAGONISTS FOR HUMAN 11CBY RECEPTORS SMITHKLINE BEECHAM PLC (GB) 2004-07-14 EP disclosed
WO-2003033480-A1 LACTAM DERIVATIVES AS ANTAGONISTS FOR HUMAN 11CBY RECEPTORS SMITHKLINE BEECHAM PLC (GB) 2003-04-24 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 (2 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-20050059651-A1 Lactam derivatives as antagonists for human 11cby receptors ADRB3, GPR3, ADRB1 MAOB 2145/4885MAOA 2682/4885ALOX5 3527/4885
US-20060287321-A1 Novel Lactam Derivatives MRPL21, PEPD, STS MAOB 2860/4885MAOA 3671/4885ALOX5 3071/4885

“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.