SCHEMBL28262152

SCHEMBL28262152

O=Cc1coc2c([N+](=O)[O-])cc(Cl)cc2c1=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 13/20 0.65
TPST2 O60704 1/20 0.43
SULT1E1 P49888 1/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
PTPN2 P17706 2/20 0.35
VCAM1 P19320 1/20 0.35
ALDH1A1 P00352 2/20 0.34
TSHR P16473 1/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
PRKDC P78527 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL29956402 1.00 PTPN1 (0.65) PTPN1TPST2SULT1E1MEN1KMT2A
SCHEMBL29954633 0.83 PTPN1 (0.50) PTPN1TPST2SULT1E1MEN1KMT2A
SCHEMBL27003687 0.83 PTPN1 (0.65) PTPN1TPST2SULT1E1MEN1KMT2A
SCHEMBL29951925 0.83 PTPN1 (0.49) PTPN1MEN1KMT2APOLBMAOA
SCHEMBL27003696 0.83 PTPN1 (0.49) PTPN1MEN1KMT2APOLBMAOA
SCHEMBL5708656 0.79 PTPN1 (1.00) PTPN1TPST2SULT1E1MEN1KMT2A
SCHEMBL29952203 0.77 PTPN1 (0.55) PTPN1MEN1KMT2APOLBMAOA
SCHEMBL29955707 0.77 PTPN1 (0.72) PTPN1TPST2SULT1E1MEN1KMT2A
SCHEMBL29956932 0.74 PTPN1 (0.68) PTPN1TPST2SULT1E1MEN1KMT2A
SCHEMBL13978677 0.69 PTPN1 (0.50) PTPN1MEN1KMT2APOLBMAOA

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-106316999-B A kind of preparation method and application of two ketoximes derivatives of benzofuran -2,3- 江苏强盛功能化学股份有限公司 2019-01-08 CN disclosed