SCHEMBL9830210

SCHEMBL9830210

O=C(Cc1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])ccc1O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.73
MEN1 O00255 6/20 0.73
MAPT P10636 4/20 0.73
ALDH1A1 P00352 4/20 0.66
HTT P42858 2/20 0.66
LMNA P02545 5/20 0.61
L3MBTL1 Q9Y468 3/20 0.57
SMN1; SMN2 Q16637 1/20 0.56
GLA P06280 1/20 0.53
KDM4E B2RXH2 1/20 0.53
CRHBP P24387 1/20 0.53
CASP3 P42574 1/20 0.53
CRHR2 Q13324 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
PABPC1 P11940 1/20 0.52
DUSP3 P51452 1/20 0.52
PTPN5 P54829 1/20 0.52
PTPN11 Q06124 1/20 0.52

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
SCHEMBL31675013 0.87 LMNA (0.80) KMT2AMEN1MAPTALDH1A1HTT
SCHEMBL29493744 0.84 MEN1 (0.67) KMT2AMEN1MAPTALDH1A1HTT
SCHEMBL4733997 0.80 KMT2A (1.00) KMT2AMEN1MAPTALDH1A1HTT
SCHEMBL9832525 0.79 MEN1 (0.62) KMT2AMEN1HTTLMNAL3MBTL1
SCHEMBL18600723 0.78 SMN1; SMN2 (0.71) KMT2AMEN1MAPTALDH1A1HTT
SCHEMBL6510957 0.78 SMN1; SMN2 (0.64) KMT2AMEN1MAPTALDH1A1HTT
SCHEMBL7753940 0.78 KMT2A (0.59) KMT2AMEN1MAPTALDH1A1HTT
SCHEMBL26098679 0.77 MAPT (0.65) KMT2AMEN1MAPTALDH1A1HTT
SCHEMBL29349665 0.76 LMNA (0.59) KMT2AMEN1MAPTALDH1A1HTT
SCHEMBL2243374 0.76 MAPT (0.72) KMT2AMEN1MAPTALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0283035-B1 BENZOXAZOLE DERIVATIVES AND PREPARATION THEREOF TANABE SEIYAKU CO., LTD. (JP) 1991-11-06 EP disclosed
US-4948900-A INTERMEDIATES FOR DIABETES THERAPEUTIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1990-08-14 US disclosed
US-4897393-A ANTIDIABETIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1990-01-30 US disclosed
EP-0283035-A1 Benzoxazole derivatives and preparation thereof TANABE SEIYAKU CO., LTD. (JP) 1988-09-21 EP disclosed