Tetranitromethane

Tetranitromethane

SCHEMBL4783630

CC(=O)n1ccnc1.O=[N+]([O-])C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAPT P10636 2/20 0.34
CYP19A1 P11511 3/20 0.33
CYP24A1 Q07973 1/20 0.33
CYP3A4 P08684 1/20 0.33
BAZ2B Q9UIF8 1/20 0.33
CYP26A1 O43174 1/20 0.30
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL26238 0.83
SCHEMBL25507680 0.83
SCHEMBL28509375 0.81
SCHEMBL28429143 0.76 CYP3A4 (0.37) ALDH1A1MAPTCYP19A1CYP24A1CYP3A4
Zinc Ion SCHEMBL28499447 0.75 HTT (0.33) ALDH1A1CYP3A4BAZ2BHTT
SCHEMBL28504192 0.74 HTT (0.34) ALDH1A1MAPTCYP24A1CYP3A4BAZ2B
SCHEMBL28901779 0.72 MAPT (0.38) ALDH1A1MAPTCYP19A1HTT
Anthracene SCHEMBL7109280 0.69 CYP19A1 (0.44) ALDH1A1CYP19A1CYP24A1CYP3A4BAZ2B
SCHEMBL10649859 0.68 NFKB1 (0.34) CYP19A1CYP3A4BAZ2B
SCHEMBL10649865 0.68 NFKB1 (0.34) CYP19A1CYP3A4BAZ2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102712671-B Phospholipase, the nucleic acid encoding it and preparation and their method of use 帝斯曼知识产权资产管理有限公司 2016-11-09 CN disclosed
CN-101437954-B The nucleic acid of zymohexase and coding zymohexase and their preparation and application CARGILL, INC. (US) 2015-09-09 CN disclosed
CN-102088989-B Glucagon analogs with enhanced solubility and stability in physiological pH buffers UNIV INDIANA RES & TECH CORP 2014-11-26 CN disclosed
CN-102438652-B Antibody formulation MEDIMMUNE LLC 2014-08-13 CN disclosed
CN-1592791-B Phytases, nucleic acids encoding them and methods of making and using them VERENIUM CORP 2012-09-05 CN disclosed
CN-101092455-B Peptides and peptidomimetics having anti-proliferative activity and/or that augment nucleic acid damaging agents or treatments CANBAS CO LTD 2012-07-04 CN disclosed
WO-2008070586-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF PROTEIN MISFOLDING AND PROTEIN AGGREGATION DISEASES UNIVERSITY OF WASHINGTON (US) 2008-06-12 WO disclosed
CN-100360564-C Peptides and peptidomimetics having antiproliferative activity and/or enhancing the effect of nucleic acid damaging agents or treatments CANBAS RES LAB LTD (JP) 2008-01-09 CN disclosed
CN-101092455-A Peptides and peptidomimetics having anti-proliferative activity and/or that augment nucleic acid damaging agents or treatments CANBAS CO LTD (JP) 2007-12-26 CN disclosed
CN-1674931-A T cell receptor CDR3 sequences and detection methods BAYLOR COLLEGE MEDICINE (US) 2005-09-28 CN disclosed
CN-1642978-A Peptides and peptidomimetics having antiproliferative activity and/or enhancing the effect of nucleic acid damaging agents or treatments CANBAS RES LAB LTD (JP) 2005-07-20 CN disclosed