SCHEMBL9525886

SCHEMBL9525886

CCOc1ccc(C(=O)Nc2c(Br)cccc2Br)cc1OC1CCCC1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 13/20 0.61
▸ PDE4A P27815 9/20 0.61
▸ PDE4B Q07343 9/20 0.61
▸ PDE4C Q08493 9/20 0.61
▸ PDE5A O76074 5/20 0.53
▸ PDE1A P54750 2/20 0.53
▸ PDE1B Q01064 2/20 0.53
▸ PDE1C Q14123 2/20 0.53
▸ MEN1 O00255 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ POLB P06746 1/20 0.47

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
SCHEMBL7332380 0.88 PDE4D (0.78) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL9530020 0.82 PDE4D (0.59) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7379219 0.81 PDE4D (0.79) PDE4DPDE4APDE4BPDE4C
SCHEMBL9525887 0.79 PDE4D (0.60) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7340940 0.77 PDE4D (0.77) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7334985 0.76 PDE4D (0.77) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7334292 0.76 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL73755 0.75 PDE4D (0.55) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7362898 0.75 PDE4D (0.59) PDE4DPDE4APDE4BPDE4CPDE5A
SCHEMBL7335862 0.75 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CPDE5A

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-0569414-A1 BENZAMIDES RHONE-POULENC RORER LIMITED (GB) 1993-11-18 — — EP disclosed
WO-1992012961-A1 BENZAMIDES RHONE POULENC RORER LIMITED (GB) 1992-08-06 — — WO disclosed
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