SCHEMBL28030477

SCHEMBL28030477

c1ccc2oc(Sc3ccc(Sc4nc5ccccc5o4)cc3)nc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDAH1 O94760 1/20 0.54
ADRA2C P18825 1/20 0.54
KMT2A Q03164 6/20 0.54
ALDH1A1 P00352 5/20 0.54
LMNA P02545 5/20 0.54
HTT P42858 3/20 0.54
POLB P06746 1/20 0.54
GFER P55789 1/20 0.54
CTSD P07339 1/20 0.50
MAPT P10636 7/20 0.48
TDP1 Q9NUW8 3/20 0.48
HPGD P15428 3/20 0.48
MEN1 O00255 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
HSP90AA1 P07900 1/20 0.48
XBP1 P17861 1/20 0.48
RECQL P46063 1/20 0.48
HKDC1 Q2TB90 1/20 0.48
RAB9A P51151 6/20 0.47
SMN1; SMN2 Q16637 5/20 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
SCHEMBL10587516 0.94 DDAH1 (0.53) DDAH1ADRA2CKMT2AALDH1A1LMNA
SCHEMBL28813270 0.91 KMT2A (0.48) DDAH1ADRA2CKMT2AALDH1A1LMNA
SCHEMBL8563586 0.91 KMT2A (0.54) DDAH1ADRA2CKMT2AALDH1A1LMNA
SCHEMBL11588358 0.91 KMT2A (0.51) DDAH1ADRA2CKMT2AALDH1A1LMNA
SCHEMBL8363008 0.91 RAB9A (0.58) DDAH1ADRA2CKMT2AALDH1A1LMNA
SCHEMBL28366757 0.90 DDAH1 (0.59) DDAH1ADRA2CKMT2AALDH1A1LMNA
SCHEMBL8561564 0.88 KMT2A (0.48) DDAH1ADRA2CKMT2AALDH1A1LMNA
SCHEMBL11343149 0.84 MAPT (0.67) KMT2AALDH1A1LMNAHTTPOLB
SCHEMBL28822248 0.84 KMT2A (0.55) DDAH1ADRA2CKMT2AALDH1A1LMNA
SCHEMBL4188069 0.81 DDAH1 (0.59) DDAH1ADRA2CKMT2AALDH1A1LMNA

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
CN-105001177-A Triaryl sulfonium salt containing benzoxazole skeleton and preparation method thereof UNIV SHANXI 2015-10-28 CN claimed