SCHEMBL8655676

SCHEMBL8655676

O=C1Nc2ccncc2C1C(=O)c1cccs1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
ALDH1A1 P00352 4/20 0.40
HTT P42858 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 1/20 0.39
PTBP1 P26599 1/20 0.39
KLF5 Q13887 1/20 0.39
KMT2A Q03164 4/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 3/20 0.37
MEN1 O00255 3/20 0.37
KDM4E B2RXH2 1/20 0.37
CASP1 P29466 1/20 0.37
BLM P54132 1/20 0.37
CASP7 P55210 1/20 0.37
HPGD P15428 1/20 0.37
ALOX12 P18054 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CES2 O00748 1/20 0.36

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
SCHEMBL8654232 0.90 POLB (0.41) POLBALDH1A1HTTSMN1; SMN2LMNA
SCHEMBL27367778 0.87 POLB (0.36) POLBALDH1A1HTTSMN1; SMN2LMNA
SCHEMBL9834046 0.82 MAPT (0.47) POLBALDH1A1HTTSMN1; SMN2KMT2A
SCHEMBL8654894 0.79 ALDH1A1 (0.34) ALDH1A1
SCHEMBL27369487 0.79 POLB (0.36) POLBALDH1A1HTTSMN1; SMN2LMNA
SCHEMBL8841799 0.77 JAK3 (0.41) ALDH1A1HTTSMN1; SMN2KMT2AMAPT
SCHEMBL8820335 0.77 KCNMA1 (0.43) ALDH1A1HTTSMN1; SMN2LMNAKMT2A
SCHEMBL8656564 0.77 TDP1 (0.41) POLBALDH1A1HTTSMN1; SMN2LMNA
SCHEMBL8652824 0.76 ALDH1A1 (0.41) POLBALDH1A1HTTSMN1; SMN2LMNA
SCHEMBL8656102 0.75 ALDH1A1 (0.40) POLBALDH1A1HTTSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5811432-A Azaoxindole derivatives PFIZER INC (US) 1998-09-22 US disclosed
CN-1031053-C Azaoxindole derivatives PFIZER (US) 1996-02-21 CN disclosed
CN-1053065-A AZAOXINDOLE DERIVATIVES PFIZER (US) 1991-07-17 CN disclosed
WO-1991009598-A1 AZAOXINDOLE DERIVATIVES PFIZER INC. (US) 1991-07-11 WO disclosed
EP-0436333-A2 Azaoxindole derivatives PFIZER INC. (US) 1991-07-10 EP disclosed