SCHEMBL16319473

SCHEMBL16319473

NC(=O)c1ccc(Oc2ccc(Cl)cc2)c(I)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 8/20 0.49
KMT2A Q03164 3/20 0.49
PARP15 Q460N3 3/20 0.49
PARP14 Q460N5 2/20 0.49
ALDH1A1 P00352 2/20 0.49
PARP16 Q8N5Y8 1/20 0.49
PARP11 Q9NR21 1/20 0.49
PARP4 Q9UKK3 1/20 0.49
CHEK2 O96017 4/20 0.47
MEN1 O00255 2/20 0.47
THRB P10828 1/20 0.47
TNKS O95271 1/20 0.46
TNKS2 Q9H2K2 1/20 0.46
PARP2 Q9UGN5 1/20 0.46
SLC6A4 P31645 3/20 0.45
HTR2A P28223 1/20 0.45
KCNH2 Q12809 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP1A2 P05177 1/20 0.45

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
SCHEMBL11696831 0.83 KMT2A (0.63) PARP10KMT2APARP15PARP14ALDH1A1
SCHEMBL8902333 0.81 PARP10 (0.50) PARP10KMT2APARP15PARP14ALDH1A1
SCHEMBL1989785 0.78 PARP10 (0.79) PARP10KMT2APARP15PARP14ALDH1A1
SCHEMBL11355202 0.78 SLC6A2 (0.58) PARP10KMT2APARP15PARP14ALDH1A1
SCHEMBL8901334 0.77 MAPT (0.48) PARP10KMT2APARP15PARP14ALDH1A1
SCHEMBL29375569 0.74 MAPK1 (0.58) PARP10KMT2AALDH1A1PARP4PARP2
SCHEMBL27486876 0.72 PARP10 (0.59) PARP10KMT2APARP15PARP14ALDH1A1
SCHEMBL5830169 0.72 TAAR5 (0.46) PARP10KMT2APARP15PARP14ALDH1A1
SCHEMBL2954394 0.71 PARP1 (0.49) PARP10KMT2APARP15PARP14ALDH1A1
SCHEMBL16319237 0.71 SLC6A4 (0.66) PARP10KMT2APARP15PARP14ALDH1A1

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-2593427-B1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LTD (GB) 2014-12-24 EP disclosed