SCHEMBL9835813

SCHEMBL9835813

CC(=O)C1(C)C(=O)Nc2cc3c(cc21)NC(C)N3

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.31
PGR P06401 1/20 0.31
IDO1 P14902 1/20 0.30

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
SCHEMBL9833591 0.88 KMT2A (0.32) ATAD2PGRIDO1
SCHEMBL9835874 0.86 ATAD2 (0.30) ATAD2PGR
SCHEMBL9833702 0.86 ATAD2 (0.30) ATAD2PGR
SCHEMBL9836473 0.86 MAPK14 (0.33) ATAD2
SCHEMBL9833058 0.84
SCHEMBL9834751 0.84
SCHEMBL9835008 0.84 KDM4E (0.34)
SCHEMBL9833669 0.82 SMN1; SMN2 (0.32)
SCHEMBL9833082 0.82 KDM4E (0.33)
SCHEMBL9834931 0.81 NQO2 (0.31) PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0214592-B1 PYRROLOBENZIMIDAZOLES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THESE PRODUCTS Roche Diagnostics GmbH (DE) 1991-08-14 EP disclosed
US-4730003-A Tricyclic compounds for treating heart and circulatory diseases BOEHRINGER MANNHEIM GMBH (DE) 1988-03-08 US disclosed
EP-0214592-A2 Pyrrolobenzimidazoles, process for their preparation and medicaments containing these products Roche Diagnostics GmbH (DE) 1987-03-18 EP disclosed