SCHEMBL6922508

SCHEMBL6922508

O=Cc1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 10/20 0.55
GAA P10253 1/20 0.52
PTGES O14684 1/20 0.52
PDE7B Q9NP56 4/20 0.51
PDE4B Q07343 2/20 0.51
PDE4D Q08499 2/20 0.51
ERN1 O75460 1/20 0.49
PLA2G4A P47712 1/20 0.46
TXNRD1 Q16881 1/20 0.44
TXNRD3 Q86VQ6 1/20 0.44
TXNRD2 Q9NNW7 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
IDO1 P14902 1/20 0.42
POLB P06746 1/20 0.41
BCL2L1 Q07817 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL7878356 0.87 PDE7A (0.53) PDE7AGAAPTGESPDE7BPDE4B
SCHEMBL6927189 0.86 MAPT (0.53) PDE7AGAAPTGESPDE7BPDE4B
SCHEMBL6929722 0.86 GAA (0.55) PDE7AGAAPTGESPDE7BPDE4B
SCHEMBL6929731 0.86 GAA (0.69) PDE7AGAAPTGESPDE7BPDE4B
SCHEMBL6927792 0.86 ERN1 (0.56) PDE7AGAAPTGESPDE7BPDE4B
SCHEMBL6927608 0.86 GAA (0.52) PDE7AGAAPTGESPDE7BPDE4B
SCHEMBL4748682 0.85 PDE7A (0.64) PDE7AGAAPTGESPDE7BPDE4B
SCHEMBL6929496 0.85 PDE7A (0.54) PDE7AGAAPTGESPDE7BPDE4B
SCHEMBL6925412 0.84 PDE7A (0.52) PDE7APDE7BPDE4BPDE4DERN1
SCHEMBL6928500 0.82 PDE7A (0.54) PDE7AGAAPTGESPDE7BPDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6518268-B1 Telomerase inhibitors and methods of their use GERON CORPORATION 2003-02-11 US disclosed
CN-1321153-A telomerase inhibitors and methods of use thereof GERON CORP (US) 2001-11-07 CN disclosed
WO-2001002377-A9 TELOMERASE INHIBITORS AND METHODS OF THEIR USE GERON CORP (US) 2001-10-11 WO disclosed
EP-1109796-A1 TELOMERASE INHIBITORS AND METHODS OF THEIR USE Geron Corporation (US) 2001-06-27 EP disclosed
WO-2001002377-A1 TELOMERASE INHIBITORS AND METHODS OF THEIR USE GERON CORPORATION (US) 2001-01-11 WO disclosed
US-5994563-A THIOPHENE DERIVATIVES, IMMUNOSUPPRESSANTS ORTHO PHARMACEUTICAL CORPORATION (US) 1999-11-30 US disclosed