SCHEMBL7008489

SCHEMBL7008489

C1=CN=CN2C(=C1)Cc1ccccc12

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HPGD P15428 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
SCHEMBL3211485 0.74 HPGD (0.33) HPGD
SCHEMBL3203392 0.67 HPGD (0.31) HPGD
SCHEMBL2057181 0.63 HPGD (0.37) HPGD
SCHEMBL10960773 0.57 HPGD (0.31) HPGD
SCHEMBL3696580 0.56 HPGD (0.44) HPGD
SCHEMBL5231220 0.55 HPGD (0.47) HPGD
SCHEMBL25138589 0.55 HPGD (0.42) HPGD
SCHEMBL20776999 0.55 NOTUM (0.44) HPGD
SCHEMBL12320654 0.55 HPGD (0.42) HPGD
SCHEMBL975897 0.55 MAOA (0.52) HPGD

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
EP-1328525-A2 2,3,4,5-TETRAHYDRO-1H-[1,4]DIAZEPINO[1,7-A]INDOLE COMPOUNDS PHARMACIA & UPJOHN COMPANY (US) 2003-07-23 EP claimed
WO-2001072752-A2 2,3,4,5-TETRAHYDRO-1H-[1,4]DIAZEPINO[1,7-a]INDOLE COMPOUNDS PHARMACIA & UPJOHN COMPANY (US) 2001-10-04 WO claimed