SCHEMBL10567103

SCHEMBL10567103

CC1C(=O)Nc2cc3[nH]c(-c4ccc(=O)oc4)nc3cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.37
PDE3B Q13370 2/20 0.36
PDE3A Q14432 2/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
RHEB Q15382 3/20 0.34
BMPR1B O00238 1/20 0.34
BMPR1A P36894 1/20 0.34
TGFBR1 P36897 1/20 0.34
ACVRL1 P37023 1/20 0.34
ACVR1 Q04771 1/20 0.34
HPSE Q9Y251 1/20 0.33
SCD O00767 1/20 0.33
GUSB P08236 6/20 0.32
MEN1 O00255 1/20 0.32
CACNA1B Q00975 1/20 0.32
APBA1 Q02410 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL10477754 0.82 NPBWR1 (0.46) PGRPDE3BPDE3APDE4APDE4B
SCHEMBL10470299 0.81 PDE3B (0.55) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10477810 0.81 TCF4 (0.51) PGRPDE3BPDE3APDE4APDE4B
SCHEMBL10571709 0.80 SIRT2 (0.39) RHEBHPSE
SCHEMBL10567302 0.78 PDE3B (0.41) PGRPDE3BPDE3APDE4APDE4B
SCHEMBL10567486 0.77 PDE4A (0.35) PGRPDE3BPDE3APDE4APDE4B
SCHEMBL10568718 0.76 PDE4A (0.32) PGRPDE3BPDE3APDE4APDE4B
SCHEMBL10373856 0.75 FBP1 (0.55) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10569181 0.74 NPC1 (0.43) PGRPDE3BPDE3APDE4APDE4B
SCHEMBL10566128 0.74 PDE3B (0.34) PGRPDE3BPDE3APDE4APDE4B

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
US-4835280-A Indoline compounds for synthesis of pharmaceutically active pyrrolobenzimidazoles BOEHRINGER MANNHEIM GMBH (DE) 1989-05-30 US disclosed
US-4695567-A Pyrrolobenzimidazoles, pharmaceutical compositions containing them and method of using them to treat certain heart and circulatory diseases BOEHRINGER MANNHEIM GMBH (DE) 1987-09-22 US disclosed
EP-0189103-A2 Pyrrolo-benzimidazoles, process for their preparation, medicaments containing them and intermediates Roche Diagnostics GmbH (DE) 1986-07-30 EP disclosed