SCHEMBL7340324

SCHEMBL7340324

N#Cc1cc2c([nH]c1=O)CCCc1cccnc1-2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HPGD P15428 6/20 0.40
PDE3A Q14432 5/20 0.40
PDE3B Q13370 4/20 0.40
PDE4A P27815 2/20 0.40
BLM P54132 2/20 0.40
PDE5A O76074 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
PTGS1 P23219 1/20 0.40
CYP2C19 P33261 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
ALDH1A1 P00352 6/20 0.39
HSD17B10 Q99714 3/20 0.39
GAA P10253 2/20 0.39
GLA P06280 1/20 0.39
CASP1 P29466 1/20 0.39

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
SCHEMBL7336559 0.93 KDM4E (0.46) KDM4ENPSR1HPGDPDE3APDE3B
SCHEMBL7341062 0.86 KDM4E (0.43) KDM4ENPSR1HPGDPDE3APDE3B
SCHEMBL7340286 0.81 NPY5R (0.40) KDM4EHPGDBLMLMNAPTGS1
SCHEMBL7340095 0.81 KDM4E (0.60) KDM4ENPSR1HPGDPDE3APDE3B
SCHEMBL7335808 0.78 KDM4E (0.64) KDM4ENPSR1HPGDPDE3APDE3B
SCHEMBL7341393 0.78 KDM4E (0.39) KDM4EHPGDLMNAPTGS1ALDH1A1
SCHEMBL11074105 0.78 KDM4E (0.40) KDM4ENPSR1HPGDPDE3APDE3B
SCHEMBL7337464 0.77 KDM4E (0.55) KDM4ENPSR1HPGDPDE3APDE3B
SCHEMBL7345382 0.77 KDM4E (0.55) KDM4ENPSR1HPGDPDE3APDE3B
SCHEMBL7344085 0.76 KDM4E (0.47) KDM4ENPSR1HPGDPDE3APDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4511569-A Tricyclic lactams and derivatives useful in increasing cardiac contractility SCHERING CORPORATION (US) 1985-04-16 US disclosed
EP-0102046-A1 Tricyclic lactams, method for making them, pharmaceutical compositions containing them SCHERING CORPORATION (US) 1984-03-07 EP disclosed