SCHEMBL7751841

SCHEMBL7751841

C1=CC2=Nc3ccccc3CN2N=C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.39
ACHE P22303 7/20 0.38
BCHE P06276 4/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
CYP3A4 P08684 1/20 0.37
CTSD P07339 1/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2D6 P10635 1/20 0.31

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
SCHEMBL7465450 0.78
SCHEMBL10767417 0.76 HPGD (0.41) SIGMAR1ACHEBCHEMEN1KMT2A
SCHEMBL15966901 0.69 KDM4E (0.30) ALDH1A1
SCHEMBL7466457 0.69 SIGMAR1 (0.38) SIGMAR1ACHEBCHEMEN1KMT2A
SCHEMBL11683434 0.63 NOS3 (0.41) SIGMAR1ACHEBCHEMEN1KMT2A
SCHEMBL31183042 0.63 SIGMAR1 (0.39) SIGMAR1ACHEBCHEMEN1KMT2A
SCHEMBL11497896 0.60 NPC1 (0.42) SIGMAR1ACHEBCHEMEN1KMT2A
SCHEMBL4573279 0.60 SIGMAR1 (0.42) SIGMAR1ACHEBCHEMEN1KMT2A
SCHEMBL6801284 0.58 SIGMAR1 (0.44) SIGMAR1ACHEBCHEMEN1KMT2A
SCHEMBL7114310 0.58 SIGMAR1 (0.44) SIGMAR1ACHEBCHEMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6111110-A Synthesis of benzo[f]quinolinones ELI LILLY AND COMPANY (US) 2000-08-29 US claimed
EP-0969003-A2 Process for the preparation of benzo[f]quinolinone derivatives and intermediates ELI LILLY AND COMPANY (US) 2000-01-05 EP claimed
EP-0839807-A1 Synthesis of benzo(f)quinolinones ELI LILLY AND COMPANY (US) 1998-05-06 EP claimed
EP-0969003-A3 Process for the preparation of benzo[f]quinolinone derivatives and intermediates ELI LILLY AND COMPANY (US) 2001-01-10 EP disclosed
US-6111110-A Synthesis of benzo[f]quinolinones ELI LILLY AND COMPANY (US) 2000-08-29 US disclosed
EP-0969003-A2 Process for the preparation of benzo[f]quinolinone derivatives and intermediates ELI LILLY AND COMPANY (US) 2000-01-05 EP disclosed
EP-0969003-A2 Process for the preparation of benzo[f]quinolinone derivatives and intermediates ELI LILLY AND COMPANY (US) 2000-01-05 EP disclosed
EP-0839807-A1 Synthesis of benzo(f)quinolinones ELI LILLY AND COMPANY (US) 1998-05-06 EP disclosed
EP-0839807-A1 Synthesis of benzo(f)quinolinones ELI LILLY AND COMPANY (US) 1998-05-06 EP disclosed