SCHEMBL1283748

SCHEMBL1283748

O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c(O)c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 9/20 0.64
ALDH1A1 P00352 3/20 0.58
KDM4E B2RXH2 2/20 0.58
MEN1 O00255 2/20 0.58
MAPT P10636 2/20 0.58
KMT2A Q03164 2/20 0.58
TTR P02766 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
HPGD P15428 1/20 0.58
ALOX15 P16050 1/20 0.58
ALOX12 P18054 1/20 0.58
MAPK1 P28482 1/20 0.58
RECQL P46063 1/20 0.58
PMP22 Q01453 1/20 0.58
HIF1A Q16665 1/20 0.58
HSD17B10 Q99714 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
CASP6 P55212 1/20 0.55
CRHBP P24387 1/20 0.54

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
SCHEMBL1479104 0.84 GPR35 (0.59) GPR35ALDH1A1KDM4EMEN1MAPT
SCHEMBL590156 0.84 GPR35 (0.59) GPR35ALDH1A1KDM4EMEN1MAPT
SCHEMBL69964 0.84 GPR35 (0.59) GPR35ALDH1A1KDM4EMEN1MAPT
SCHEMBL29262876 0.84 GPR35 (0.63) GPR35ALDH1A1KDM4EMEN1MAPT
SCHEMBL11211745 0.84 GPR35 (0.52) GPR35ALDH1A1KDM4EMEN1MAPT
SCHEMBL9112380 0.82 GPR35 (0.83) GPR35ALDH1A1KDM4EMEN1MAPT
Ammonia Solution, Strong SCHEMBL11020682 0.82 GPR35 (0.57) GPR35ALDH1A1KDM4EMEN1MAPT
SCHEMBL9500870 0.82 GPR35 (0.68) GPR35ALDH1A1KDM4EMEN1MAPT
SCHEMBL9724485 0.82 GPR35 (0.57) GPR35ALDH1A1KDM4EMEN1MAPT
SCHEMBL9328126 0.82 GPR35 (0.57) GPR35ALDH1A1KDM4EMEN1MAPT

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 192 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112320766-B Preparation method and application of hollow mesoporous inorganic oxide nanosphere solid alkali 西南大学 2023-10-27 CN claimed
CN-112320766-A Preparation method and application of hollow mesoporous inorganic oxide nanosphere solid base 西南大学 2021-02-05 CN claimed
CN-112320766-B Preparation method and application of hollow mesoporous inorganic oxide nanosphere solid alkali 西南大学 2023-10-27 CN disclosed
US-11292929-B2 UV curable inkjet inks AGFA NV (BE) 2022-04-05 US disclosed
CN-108137974-B UV curable inkjet inks 爱克发印艺公司 2021-09-24 CN disclosed
CN-108350295-B UV curable inkjet inks 爱克发有限公司 2021-08-31 CN disclosed
CN-112320766-A Preparation method and application of hollow mesoporous inorganic oxide nanosphere solid base 西南大学 2021-02-05 CN disclosed
US-20200101102-A1 TREATMENT OF CANCER USING TLR9 AGONIST WITH CHECKPOINT INHIBITORS IDERA PHARMACEUTICALS, INC. (US) 2020-04-02 US disclosed
EP-3156461-B1 UV CURABLE INKJET INKS AGFA NV (BE) 2020-04-01 EP disclosed
US-10584258-B2 UV curable inkjet inks AGFA NV (BE) 2020-03-10 US disclosed
US-10513620-B2 UV curable inkjet inks AGFA NV (BE) 2019-12-24 US disclosed
US-20040020568-A1 Non-toxic corrosion-protection conversion coats based on rare earth elements DAYTON, UNIVERSITY OF 2004-02-05 US disclosed
US-20040016910-A1 Non-toxic corrosion-protection rinses and seals based on rare earth elements DAYTON, UNIVERSITY OF 2004-01-29 US disclosed
US-20040011252-A1 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON 2004-01-22 US disclosed
US-20030234063-A1 Non-toxic corrosion-protection conversion coats based on cobalt DAYTON, UNIVERSITY OF 2003-12-25 US disclosed
US-20030230363-A1 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON 2003-12-18 US disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US 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-20200101102-A1 TREATMENT OF CANCER USING TLR9 AGONIST WITH CHECKPOINT INHIBITORS TLR9, TLR3, TLR7 GPR35 211/4885ALDH1A1 4012/4885KDM4E 1096/4885

“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.