SCHEMBL9039030

SCHEMBL9039030

CCc1cc2c(=O)n(C)c(=O)n(C)c2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 6/20 0.54
PDE3A Q14432 6/20 0.54
POLB P06746 1/20 0.42
PABPC1 P11940 1/20 0.42
GAA P10253 3/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
LGMN Q99538 1/20 0.40
CYP2C9 P11712 2/20 0.39
CYP1A2 P05177 1/20 0.39
PARP1 P09874 1/20 0.38
THRB P10828 1/20 0.36
KDM4E B2RXH2 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL6693127 0.83 PDE3B (0.49) PDE3BPDE3AKMT2APARP1
SCHEMBL15917986 0.78 PDE3B (0.80) PDE3BPDE3ATHRB
SCHEMBL27093179 0.70 PDE3B (0.49) PDE3BPDE3APOLBPABPC1LGMN
SCHEMBL15917628 0.70 PDE3B (1.00) PDE3BPDE3AGAAKMT2ALGMN
SCHEMBL15918409 0.70 PDE3B (1.00) PDE3BPDE3APOLBPABPC1GAA
SCHEMBL15917778 0.68 PDE3B (0.80) PDE3BPDE3AGAAHTTKDM4E
SCHEMBL15917702 0.67 PDE3B (0.78) PDE3BPDE3APOLBHTT
SCHEMBL15917457 0.67 PDE3B (1.00) PDE3BPDE3APOLBKMT2ARXFP1
SCHEMBL15930074 0.67 PDE3B (0.78) PDE3BPDE3AGAATHRB
SCHEMBL15917729 0.67 PDE3B (1.00) PDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0736569-A1 Derivatives of pyrrolodiazine as stabilisers for polymers containing chlorine CIBA-GEIGY AG (CH) 1996-10-09 EP disclosed