Nitrapyrin

Nitrapyrin

SCHEMBL21777792

CC(C)[C@H](N)C(=O)O.Clc1cccc(C(Cl)(Cl)Cl)n1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.59
TSHR P16473 1/20 0.59
SLC7A5 Q01650 1/20 0.44
SLC1A3 P43003 9/20 0.40
SLC1A2 P43004 8/20 0.40
SLC1A1 P43005 6/20 0.40
ALDH1A1 P00352 3/20 0.38
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CASR P41180 1/20 0.36
MAPT P10636 1/20 0.36
MEN1 O00255 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
TARS1 P26639 1/20 0.33
SLC15A1 P46059 1/20 0.33

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
Nitrapyrin SCHEMBL4115039 0.77 CYP3A4 (1.00) CYP3A4TSHRALDH1A1GAAMAPT
Nitrapyrin SCHEMBL41442 0.77 CYP3A4 (1.00) CYP3A4TSHRALDH1A1GAAMAPT
Nitrapyrin SCHEMBL29349488 0.77 CYP3A4 (1.00) CYP3A4TSHRALDH1A1GAAMAPT
Nitrapyrin SCHEMBL21758631 0.75 CYP3A4 (0.95) CYP3A4TSHRALDH1A1GAAMAPT
Nitrapyrin SCHEMBL27959341 0.75 CYP3A4 (0.95) CYP3A4TSHRALDH1A1GAAMAPT
Valine SCHEMBL27817390 0.75 SLC7A5 (0.79) SLC7A5SLC1A3SLC1A2SLC1A1ALDH1A1
Valine SCHEMBL1842424 0.74 TDP1 (0.52) SLC7A5SLC1A3SLC1A2SLC1A1ALDH1A1
Valine SCHEMBL15208663 0.73 ALDH1A1 (0.55) SLC7A5SLC1A3SLC1A2SLC1A1ALDH1A1
Valine SCHEMBL598198 0.73 SLC7A5 (0.47) SLC7A5SLC1A3SLC1A2SLC1A1ALDH1A1
Valine SCHEMBL4582565 0.71 SLC7A5 (0.88) SLC7A5SLC1A3SLC1A2SLC1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4392393-A1 CORROSION INHIBITORS FOR NITROGEN INHIBITOR FORMULATIONS Verdesian Life Sciences U.S., LLC (US) 2024-07-03 EP disclosed
WO-2023038823-A1 CORROSION INHIBITORS FOR NITROGEN INHIBITOR FORMULATIONS VERDESIAN LIFE SCIENCES U.S., LLC (US) 2023-03-16 WO disclosed
WO-2021141855-A1 NITRAPYRIN COMPOSITIONS FOR ENHANCING NITROGEN NUTRIENT USE EFFICIENCY AND IMPROVING PLANT GROWH VERDESIAN LIFE SCIENCES U.S., LLC (US) 2021-07-15 WO disclosed
EP-3823998-A1 NITRAPYRIN COMPOSITIONS FOR ENHANCING NITROGEN NUTRIENT USE EFFICIENCY AND IMPROVING PLANT GROWTH Verdesian Life Sciences U.S., LLC (US) 2021-05-26 EP disclosed
WO-2020046819-A1 NITRAPYRIN COMPOSITIONS FOR ENHANCING NITROGEN NUTRIENT USE EFFICIENCY AND IMPROVING PLANT GROWTH VERDESIAN LIFE SCIENCES U.S., LLC (US) 2020-03-05 WO disclosed