SCHEMBL6850686

SCHEMBL6850686

O=C(O)c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 1/20 0.64
ACMSD Q8TDX5 1/20 0.64
ALDH1A1 P00352 6/20 0.54
TDP1 Q9NUW8 3/20 0.54
CYP3A4 P08684 2/20 0.54
ALOX15 P16050 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
MAPT P10636 3/20 0.50
POLB P06746 1/20 0.50
MAPK1 P28482 1/20 0.50
SIRT5 Q9NXA8 1/20 0.49
PPM1B O75688 1/20 0.49
GAA P10253 1/20 0.49
ESR2 Q92731 1/20 0.49
KDM4E B2RXH2 1/20 0.49
PTPN1 P18031 1/20 0.49
KMT2A Q03164 1/20 0.48
XDH P47989 1/20 0.48
SLC22A12 Q96S37 1/20 0.48
CA12 O43570 1/20 0.47

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
SCHEMBL4829731 0.87 TDP1 (0.66) HNF4AACMSDALDH1A1TDP1CYP3A4
SCHEMBL11229565 0.86 TDP1 (0.57) HNF4AACMSDALDH1A1TDP1CYP3A4
SCHEMBL578933 0.86 ALDH1A1 (0.66) ALDH1A1TDP1CYP3A4ALOX15SMN1; SMN2
SCHEMBL28281676 0.84 ALDH1A1 (0.64) ALDH1A1TDP1CYP3A4ALOX15SMN1; SMN2
SCHEMBL18735541 0.84 ACMSD (0.88) HNF4AACMSDALDH1A1CYP3A4MAPT
SCHEMBL1761340 0.82 KMT2A (0.55) ALDH1A1TDP1CYP3A4ALOX15SMN1; SMN2
SCHEMBL1761421 0.82 TDP1 (0.53) ALDH1A1TDP1CYP3A4ALOX15MAPT
SCHEMBL27913302 0.82 ALDH1A1 (0.76) ALDH1A1TDP1CYP3A4ALOX15SMN1; SMN2
SCHEMBL29441950 0.82 ACMSD (0.83) HNF4AACMSDALDH1A1CYP3A4MAPT
SCHEMBL2773864 0.82 ACMSD (0.83) HNF4AACMSDALDH1A1CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200197418-A1 COMPOUNDS FOR THE TREATMENT OF DISEASES CAUSED BY OXALATE ACCUMULATION UNIV GRANADA (ES) 2020-06-25 US disclosed
EP-1294378-A4 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORP (US) 2004-01-28 EP disclosed
EP-1294378-A2 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2003-03-26 EP disclosed
WO-2001089457-A2 THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2001-11-29 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 (1 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-20200197418-A1 COMPOUNDS FOR THE TREATMENT OF DISEASES CAUSED BY OXALATE ACCUMULATION DOHH, OGDH, EGLN2 HNF4A 4553/4885ACMSD 1084/4885ALDH1A1 454/4885

“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.