SCHEMBL257552

SCHEMBL257552

CC1Cc2cc([N+](=O)[O-])ccc2N1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
PNMT P11086 8/20 0.61
ADRA2A P08913 6/20 0.61
ADRA2B P18089 3/20 0.61
ADRA2C P18825 3/20 0.61
GAA P10253 2/20 0.57
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL6968655 1.00 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2PNMTADRA2AADRA2B
SCHEMBL2857664 0.84 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2PNMTADRA2AADRA2B
SCHEMBL28239780 0.81 PNMT (0.47) ALDH1A1SMN1; SMN2PNMTADRA2AADRA2B
SCHEMBL6966089 0.80 PNMT (0.50) ALDH1A1SMN1; SMN2PNMTADRA2AADRA2B
SCHEMBL7008122 0.80 PNMT (0.47) ALDH1A1SMN1; SMN2PNMTADRA2AADRA2B
SCHEMBL13062867 0.78 PNMT (0.44) ALDH1A1SMN1; SMN2PNMTADRA2AADRA2B
SCHEMBL27897828 0.78 PNMT (0.45) ALDH1A1SMN1; SMN2PNMTADRA2AADRA2B
SCHEMBL8247179 0.77 PNMT (0.57) ALDH1A1SMN1; SMN2PNMTADRA2AADRA2B
SCHEMBL10293160 0.77 GAA (0.54) ALDH1A1SMN1; SMN2PNMTADRA2AADRA2B
SCHEMBL6371190 0.77 PNMT (0.50) ALDH1A1SMN1; SMN2PNMTADRA2AADRA2B

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
EP-3917907-B1 MODULATORS OF POTASSIUM ION CHANNELS AND USES THEREOF UNIV DEGLI STUDI DI SALERNO (IT) 2025-05-21 EP disclosed
CN-103180294-B Diamines, polyimide precursor, polyimide, liquid crystal aligning agent, liquid crystal orientation film and liquid crystal display device NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-09-23 CN disclosed
CN-103180294-A Diamine, polyimide precursor, polyimide, liquid-crystal alignment material, liquid-crystal alignment film, and liquid-crystal display element NISSAN CHEMICAL IND LTD 2013-06-26 CN disclosed
US-20130029846-A1 Fungicidal Iminoderivatives BASF SE (DE) 2013-01-31 US disclosed
WO-2012029763-A1 DIAMINE, POLYIMIDE PRECURSOR, POLYIMIDE, LIQUID-CRYSTAL ALIGNMENT MATERIAL, LIQUID-CRYSTAL ALIGNMENT FILM, AND LIQUID-CRYSTAL DISPLAY ELEMENT 日産化学工業株式会社 (JP) 2012-03-08 WO disclosed
US-20070270445-A1 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors BERTHEL STEVEN J 2007-11-22 US disclosed
US-20070270445-A1 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors BERTHEL STEVEN J 2007-11-22 US disclosed
CN-100344629-C Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors HOFFMANN LA ROCHE (CH) 2007-10-24 CN disclosed
US-7262297-B2 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors HOFFMANN-LA ROCHE INC. (US) 2007-08-28 US disclosed
US-7262297-B2 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors HOFFMANN-LA ROCHE INC. (US) 2007-08-28 US disclosed
CN-1791603-A Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors HOFFMANN LA ROCHE (CH) 2006-06-21 CN disclosed
CN-1142162-C Bicyclic oxazolidinones as antibacterial agents �������Ŷ���Լ��������˾ 2004-03-17 CN disclosed
EP-1181288-B1 BICYCLIC OXAZOLIDINONES AS ANTIBACTERIAL AGENT UPJOHN CO (US) 2003-07-30 EP disclosed
US-20020143009-A1 Novel bicyclic oxazolidinones as antibacterial agents PHARMACIA & UPJOHN 2002-10-03 US disclosed
CN-1353709-A Bicyclic oxazolidinones as antibacterial agents PHARMACIA & UP JOHN CO (US) 2002-06-12 CN disclosed
US-6387896-B1 GRAMNEGATIVE, GRAMPOSITVE BACTERIA PHARMACIA & UPJOHN CO. 2002-05-14 US disclosed
EP-1181288-A1 BICYCLIC OXAZOLIDINONES AS ANTIBACTERIAL AGENT PHARMACIA & UPJOHN COMPANY (US) 2002-02-27 EP disclosed
WO-2000073301-A1 BICYCLIC OXAZOLIDINONES AS ANTIBACTERIAL AGENT PHARMACIA & UPJOHN COMPANY (US) 2000-12-07 WO 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 (3 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-20130029846-A1 Fungicidal Iminoderivatives CYP1B1, CYP1A1, CYP51A1 ALDH1A1 506/4885SMN1; SMN2 2998/4885PNMT 433/4885
US-20020143009-A1 Novel bicyclic oxazolidinones as antibacterial agents OXA1L, MRPL21, RPS4Y1 ALDH1A1 1430/4885SMN1; SMN2 3570/4885PNMT 4853/4885
US-20070270445-A1 Diaminopyrroloquinazolines compounds as protein tyrosine phosphatase inhibitors PTPN5, DUSP15, PPP5C ALDH1A1 1309/4885SMN1; SMN2 3625/4885PNMT 1081/4885

“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.