SCHEMBL665096

SCHEMBL665096

O=C(O)c1nc([N+](=O)[O-])c[nH]1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.34
CASP6 P55212 2/20 0.33
DNA2 P51530 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
F2 P00734 1/20 0.33
PLAU P00749 1/20 0.33
KLKB1 P03952 1/20 0.33
ELANE P08246 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
APEX1 P27695 1/20 0.32
SRD5A2 P31213 1/20 0.32
ALDH1A1 P00352 2/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
PIN1 Q13526 1/20 0.31
TP53 P04637 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL5310321 0.79 NPSR1 (0.39) TDP1F2SMN1; SMN2ALDH1A1TP53
SCHEMBL1595448 0.75 MITF (0.44) SMN1; SMN2ALDH1A1PTGS1PTGS2LMNA
SCHEMBL8372779 0.74 SRC (0.42) F2PLAUKLKB1ELANEALDH1A1
SCHEMBL5311270 0.73
SCHEMBL19279017 0.73 ALDH1A1 (0.37) TDP1F2PLAUKLKB1ELANE
SCHEMBL28920099 0.73 ALDH1A1 (0.33) TDP1SMN1; SMN2ALDH1A1MAPT
SCHEMBL64072 0.73 CYP3A4 (0.33) TDP1SMN1; SMN2APEX1ALDH1A1LMNA
Propionic Acid SCHEMBL8040155 0.72 ALDH1A1 (0.39) CASP6ALDH1A1MAPT
SCHEMBL28819045 0.71 CYP3A4 (0.32) TDP1SMN1; SMN2APEX1ALDH1A1LMNA
SCHEMBL27960253 0.71 CYP3A4 (0.32) TDP1SMN1; SMN2APEX1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230059863-A1 SEPARATION OF RARE EARTH METALS UNIV BELFAST (GB) 2023-02-23 US claimed
US-11396684-B2 Extracting rare earth metal from acidic solution by contacting with ionic liquid composition THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2022-07-26 US claimed
EP-3555325-B1 SEPARATION OF RARE EARTH METALS UNIV BELFAST (GB) 2021-06-30 EP claimed
US-10626335-B2 Process for removing metals from hydrocarbons PETROLIAM NASIONAL BERHAD (PETRONAS) (MY) 2020-04-21 US claimed
US-20200080169-A1 SEPARATION OF RARE EARTH METALS THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2020-03-12 US claimed
EP-2417225-B1 PROCESS FOR REMOVING MERCURY FROM HYDROCARBONS PETROLIAM NASIONAL BERHAD PETRONAS (MY) 2020-03-11 EP claimed
EP-3555325-A1 SEPARATION OF RARE EARTH METALS The Queen's University Of Belfast (GB) 2019-10-23 EP claimed
US-10138432-B2 Process for removing metals from hydrocarbons THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2018-11-27 US claimed
WO-2018109483-A1 SEPARATION OF RARE EARTH METALS THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2018-06-21 WO claimed
US-20170037323-A1 PROCESS FOR REMOVING METALS FROM HYDROCARBONS PETROLIAM NASIONAL BERHAD (PETRONAS) (MY) 2017-02-09 US claimed
EP-2625249-B1 PROCESS FOR REMOVING METALS FROM HYDROCARBONS THE QUEEN'S UNIV OF BELFAST (GB) 2017-01-04 EP claimed
EP-3095841-A1 PROCESS FOR REMOVING METALS FROM HYDROCARBONS The Queen's University Of Belfast (GB) 2016-11-23 EP claimed
US-9447335-B2 Process for removing metals from hydrocarbons THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2016-09-20 US claimed
US-20140001100-A1 PROCESS FOR REMOVING METALS FROM HYDROCARBONS THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2014-01-02 US claimed
EP-2625249-A2 PROCESS FOR REMOVING METALS FROM HYDROCARBONS The Queen's University of Belfast (GB) 2013-08-14 EP claimed
US-20120234687-A1 SOLDERING PROCESS USING ELECTRODEPOSITED INDIUM AND/OR GALLIUM, AND ARTICLE COMPRISING AN INTERMEDIATE LAYER WITH INDIUM AND/OR GALLIUM ASTRON ADVANCED MATERIALS LIMITED (GB) 2012-09-20 US claimed
EP-2475496-A1 SOLDERING PROCESS USING ELECTRODEPOSITED INDIUM AND/OR GALLIUM, AND ARTICLE COMPRISING AN INTERMEDIATE LAYER WITH INDIUM AND/OR GALLIUM Astron Advanced Materials Limited (GB) 2012-07-18 EP claimed
US-20120121485-A1 PROCESS FOR REMOVING METALS FROM HYDROCARBONS PETROLIAM NASIONAL BERHAD (PETRONAS) (MY) 2012-05-17 US claimed
WO-2012046057-A2 PROCESS FOR REMOVING METALS FROM HYDROCARBONS THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2012-04-12 WO claimed
WO-2010116165-A2 PROCESS FOR REMOVING METALS FROM HYDROCARBONS PETROLIAM NASIONAL BERHAD (PETRONAS) (MY) 2010-10-14 WO claimed

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-10626335-B2 Process for removing metals from hydrocarbons SHH, AHR, HTT TDP1 3757/4885CASP6 3881/4885DNA2 2674/4885
US-20120121485-A1 PROCESS FOR REMOVING METALS FROM HYDROCARBONS SHH, AHR, HTT TDP1 3757/4885CASP6 3881/4885DNA2 2674/4885

“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.