SCHEMBL182798

SCHEMBL182798

O=C1Cc2cc([N+](=O)[O-])ccc2ON1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 4/20 0.54
MEN1 O00255 3/20 0.48
MAPT P10636 3/20 0.48
KMT2A Q03164 3/20 0.48
PNMT P11086 4/20 0.42
ADRA2A P08913 2/20 0.42
LMNA P02545 1/20 0.42
RAB9A P51151 1/20 0.42
TLR9 Q9NR96 1/20 0.42
PGR P06401 1/20 0.42
PARP1 P09874 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
ALDH1A1 P00352 2/20 0.39
GRIA1 P42261 1/20 0.39
GRIA2 P42262 1/20 0.39
GRIA3 P42263 1/20 0.39
GRIA4 P48058 1/20 0.39
CYP3A4 P08684 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL983449 0.76 MEN1 (0.51) TDP2MEN1MAPTKMT2APNMT
SCHEMBL2081772 0.74 TDP2 (0.60) TDP2MEN1MAPTKMT2APNMT
SCHEMBL30839537 0.74 TDP2 (0.60) TDP2MEN1MAPTKMT2APNMT
SCHEMBL21247680 0.74 TDP2 (0.60) TDP2MEN1MAPTKMT2APNMT
SCHEMBL4847672 0.73 MAOA (0.40) TDP2MAPTRAB9AALDH1A1CYP3A4
SCHEMBL542110 0.73 TDP2 (0.49) TDP2MEN1MAPTKMT2APNMT
SCHEMBL3922665 0.73 AHR (0.51) TDP2MEN1MAPTKMT2APGR
SCHEMBL2616914 0.73 TDP2 (0.73) TDP2MEN1MAPTKMT2APNMT
SCHEMBL182522 0.73 CASP1 (0.42) TDP2MEN1MAPTKMT2ALMNA
SCHEMBL3346103 0.73 TDP2 (0.44) TDP2MEN1MAPTKMT2APNMT

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108727367-B Benzoxazinone compound containing pyridopyrimidinedione, preparation method and application thereof, and herbicide composition 山东先达农化股份有限公司 2021-01-05 CN disclosed
CN-108727367-A Benzoxazinones containing pyridopyrimidine dione and its preparation method and application and herbicidal composition 山东先达农化股份有限公司 2018-11-02 CN disclosed
US-9975862-B2 Arylpiperazine derivatives and methods of utilizing same REVIVA PHARMACEUTICALS, INC. (US) 2018-05-22 US disclosed
US-20170327477-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME REVIVA PHARMACEUTICALS INC (US) 2017-11-16 US disclosed
US-9604944-B2 Arylpiperazine derivatives and methods of utilizing same REVIVA PHARMACEUTICALS, INC. (US) 2017-03-28 US disclosed
EP-2400968-B1 COMPOSITIONS, SYNTHESIS, AND METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES REVIVA PHARMACEUTICALS INC (US) 2016-09-28 EP disclosed
US-20160229821-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME REVIVA PHARMACEUTICALS INC (US) 2016-08-11 US disclosed
US-9255076-B2 Arylpiperazine derivatives and methods of utilizing same REVIVA PHARMACEUTICALS, INC. (US) 2016-02-09 US disclosed
US-20150166493-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME REVIVA PHARMACEUTICALS INC (US) 2015-06-18 US disclosed
US-8980883-B2 Arylpiperazine derivatives and methods of utilizing same REVIVA PHARMACEUTICALS, INC. (US) 2015-03-17 US disclosed
US-20120220574-A1 METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES BHAT LAXMINARAYAN (US) 2012-08-30 US disclosed
US-20120220579-A1 METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES BHAT LAXMINARAYAN (US) 2012-08-30 US disclosed
US-8188076-B2 Compositions, synthesis, and methods of utilizing arylpiperazine derivatives REVIVA PHARMACEUTICALS, INC. (US) 2012-05-29 US disclosed
EP-2400968-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES Reviva Pharmaceuticals, Inc. (US) 2012-01-04 EP disclosed
WO-2010099502-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES REVIVA PHARMACEUTICALS, INC. (US) 2010-09-02 WO disclosed
US-20100216783-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES REVIVA PHARMACEUTICALS, INC. 2010-08-26 US disclosed
US-7354915-B2 6-amino-1,4-dihydro-benzo[d][1,3]oxazin-2-ones and analogs useful as progesterone receptor modulators WYETH (US) 2008-04-08 US disclosed
US-20070225281-A1 6-Amino-1,4-dihydro-benzo[d][1,3]oxazin-2-ones and analogs useful as progesterone receptor modulators WYETH (US) 2007-09-27 US disclosed
US-7247625-B2 6-amino-1,4-dihydro-benzo[d][1,3] oxazin-2-ones and analogs useful as progesterone receptor modulators WYETH (US) 2007-07-24 US disclosed
US-20050085470-A1 6-Amino-1,4-dihydro-benzo[d][1,3] oxazin-2-ones and analogs useful as progesterone receptor modulators WYETH 2005-04-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170327477-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME GRIK5, HTR5A, GRIK2 TDP2 2290/4885MEN1 4057/4885MAPT 2251/4885
US-20160229821-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME GRIK5, HTR5A, GRIK2 TDP2 2290/4885MEN1 4057/4885MAPT 2251/4885
US-20120220579-A1 METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES HTR5A, GRIK5, HTR2A TDP2 2131/4885MEN1 4375/4885MAPT 2635/4885
US-20120220574-A1 METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES HTR5A, GRIK5, HTR2A TDP2 2131/4885MEN1 4375/4885MAPT 2635/4885
US-20050085470-A1 6-Amino-1,4-dihydro-benzo[d][1,3] oxazin-2-ones and analogs useful as progesterone receptor modulators PGR, FSHR, GPR6 TDP2 4488/4885MEN1 3752/4885MAPT 4773/4885
US-20070225281-A1 6-Amino-1,4-dihydro-benzo[d][1,3]oxazin-2-ones and analogs useful as progesterone receptor modulators PGR, FSHR, GPR6 TDP2 4488/4885MEN1 3752/4885MAPT 4773/4885
US-20150166493-A1 ARYLPIPERAZINE DERIVATIVES AND METHODS OF UTILIZING SAME GRIK5, HTR5A, HTR2A TDP2 1699/4885MEN1 4177/4885MAPT 2286/4885
US-20100216783-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF UTILIZING ARYLPIPERAZINE DERIVATIVES GRIK5, HTR5A, KYNU TDP2 2350/4885MEN1 3412/4885MAPT 1726/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.