Nitrous Acid

Nitrous Acid

SCHEMBL6665052

CC=Cc1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1.O=NO

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.67
NR1I2 O75469 1/20 0.59
NR4A2 P43354 1/20 0.59
PDE4D Q08499 1/20 0.59
PRKAA2 P54646 1/20 0.57
HMGCR P04035 3/20 0.57
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
PARP2 Q9UGN5 1/20 0.34
GRM2 Q14416 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SCN9A Q15858 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
Nitrous Acid SCHEMBL7524974 1.00 RXRA (0.67) RXRANR1I2NR4A2PDE4DPRKAA2
SCHEMBL10129907 0.93 RXRA (0.68) RXRANR1I2NR4A2PDE4DPRKAA2
SCHEMBL526489 0.93 RXRA (0.68) RXRANR1I2NR4A2PDE4DPRKAA2
SCHEMBL526488 0.93 RXRA (0.68) RXRANR1I2NR4A2PDE4DPRKAA2
SCHEMBL15247428 0.85 RXRA (0.56) RXRANR1I2NR4A2PDE4DPRKAA2
SCHEMBL6283365 0.84 RXRA (0.84) RXRANR1I2NR4A2PDE4DPRKAA2
SCHEMBL6283353 0.84 RXRA (0.84) RXRANR1I2NR4A2PDE4DPRKAA2
SCHEMBL29466456 0.82 RXRA (0.75) RXRANR1I2NR4A2PDE4DPRKAA2
SCHEMBL1844436 0.82 RXRA (0.75) RXRANR1I2NR4A2PDE4DPRKAA2
SCHEMBL1843198 0.82 RXRA (0.75) RXRANR1I2NR4A2PDE4DPRKAA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030114680-A1 PROCESS FOR THE PREPARATION OF QUINOLYLPROPENAL UBE INDUSTRIES LTD (JP) 2003-06-19 US claimed
US-20030013885-A1 PROCESS FOR PREPARING QUINOLYLACRYLONITRILE AND INTERMEDIATES THEREFOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-01-16 US claimed
EP-1251124-A1 PROCESS FOR THE PREPARATION OF QUINOLYLPROPENAL Ube Industries, Ltd. (JP) 2002-10-23 EP claimed
EP-1251123-A1 PROCESS FOR PREPARING QUINOLYLACRYLONITRILE AND INTERMEDIATES THEREFOR Ube Industries, Ltd. (JP) 2002-10-23 EP claimed
EP-1251123-B1 PROCESS FOR PREPARING QUINOLYLACRYLONITRILE AND INTERMEDIATES THEREFOR NISSAN CHEMICAL IND LTD (JP) 2004-07-21 EP disclosed
US-20030114680-A1 PROCESS FOR THE PREPARATION OF QUINOLYLPROPENAL UBE INDUSTRIES LTD (JP) 2003-06-19 US disclosed
US-20030114680-A1 PROCESS FOR THE PREPARATION OF QUINOLYLPROPENAL UBE INDUSTRIES LTD (JP) 2003-06-19 US disclosed
US-20030013885-A1 PROCESS FOR PREPARING QUINOLYLACRYLONITRILE AND INTERMEDIATES THEREFOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-01-16 US disclosed
US-20030013885-A1 PROCESS FOR PREPARING QUINOLYLACRYLONITRILE AND INTERMEDIATES THEREFOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-01-16 US disclosed
EP-1251124-A1 PROCESS FOR THE PREPARATION OF QUINOLYLPROPENAL Ube Industries, Ltd. (JP) 2002-10-23 EP disclosed
EP-1251123-A1 PROCESS FOR PREPARING QUINOLYLACRYLONITRILE AND INTERMEDIATES THEREFOR Ube Industries, Ltd. (JP) 2002-10-23 EP disclosed
EP-1251123-A1 PROCESS FOR PREPARING QUINOLYLACRYLONITRILE AND INTERMEDIATES THEREFOR Ube Industries, Ltd. (JP) 2002-10-23 EP disclosed
JP-2002155056-A METHOD FOR PRODUCING QUINOLYLACRYLONITRILE DERIVATIVE UBE IND LTD 2002-05-28 JP disclosed
US-6335449-B1 ANTICHOLESTEROL, ENZYME INHIBITOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2002-01-01 US disclosed
JP-2001199964-A METHOD FOR PRODUCING QUINOLYLPROPENAL UBE IND LTD 2001-07-24 JP disclosed
JP-2001199962-A METHOD FOR PRODUCING QUINOLYLACRYLONITRILE AND INTERMEDIATE THEREOF UBE IND LTD 2001-07-24 JP disclosed
JP-2001199963-A METHOD FOR PRODUCING QUINOLYLPROPENAL UBE IND LTD 2001-07-24 JP disclosed
EP-1099694-A1 PROCESS FOR THE PREPARATION OF QUINOLINE DERIVATIVE AND INTERMEDIATE THEREFOR Nissan Chemical Industries, Ltd. (JP) 2001-05-16 EP 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 (2 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-20030013885-A1 PROCESS FOR PREPARING QUINOLYLACRYLONITRILE AND INTERMEDIATES THEREFOR WEE2, WEE1, CYP4F11 RXRA 3421/4885NR1I2 4273/4885NR4A2 2310/4885
US-20030114680-A1 PROCESS FOR THE PREPARATION OF QUINOLYLPROPENAL PRDX6, PRDX2, PRDX4 RXRA 3571/4885NR1I2 4353/4885NR4A2 3713/4885

“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.