SCHEMBL15470902

SCHEMBL15470902

COC(=O)C(C(=O)c1ccccc1)=C1c2ccccc2Sc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
CES2 O00748 6/20 0.39
CES1 P23141 6/20 0.39
BCHE P06276 3/20 0.39
ACHE P22303 2/20 0.36
HPGD P15428 3/20 0.36
ALDH1A1 P00352 3/20 0.36
POLB P06746 2/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 2/20 0.36
HSD17B10 Q99714 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
PLEC Q15149 1/20 0.36
MAPT P10636 2/20 0.35
SLC6A3 Q01959 1/20 0.35
PTGS2 P35354 1/20 0.34
OPRK1 P41145 1/20 0.34
PDE4D Q08499 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL15470961 0.89 BCHE (0.46) BCHEACHEHPGDALDH1A1POLB
SCHEMBL15470876 0.86 TSHR (0.46) TSHRCES2CES1HPGDALDH1A1
SCHEMBL15470895 0.82 MAPT (0.42) TSHRBCHEACHEHPGDALDH1A1
SCHEMBL25058860 0.82 BCHE (0.41) BCHEACHEHPGDALDH1A1POLB
SCHEMBL15470893 0.82 MAPT (0.47) TSHRCES2CES1HPGDALDH1A1
SCHEMBL15470903 0.81 TSHR (0.41) TSHRCES2CES1HPGDALDH1A1
SCHEMBL15470927 0.78 GPR3 (0.42) TSHRCES2CES1HPGDALDH1A1
SCHEMBL15470921 0.77 TSHR (0.38) TSHRCES2CES1HPGDALDH1A1
SCHEMBL21908167 0.76 BCHE (0.44) BCHEACHEHPGDALDH1A1POLB
SCHEMBL23209617 0.76 BCHE (0.36) BCHEHPGDALDH1A1POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9926289-B2 Compositions, apparatus, systems, and methods for resolving electronic excited states BANK OF AMERICA, N.A., AS ADMINISTRATIVE AGENT 2018-03-27 US disclosed
US-9765051-B2 Compositions, apparatus, systems, and methods for resolving electronic excited states HALLSTAR INNOVATIONS CORP. (US) 2017-09-19 US disclosed
US-9650356-B2 2017-05-16 US disclosed
US-9611246-B2 Compositions, apparatus, systems, and methods for resolving electronic excited states HALLSTAR INNOVATIONS CORP. (US) 2017-04-04 US disclosed
US-20160024046-A1 COMPOSITIONS, APPARATUS, SYSTEMS, AND METHODS FOR RESOLVING ELECTRONIC EXCITED STATES BANK OF AMERICA, N.A., AS ADMINISTRATIVE AGENT 2016-01-28 US disclosed
US-20160022555-A1 COMPOSITIONS, APPARATUS, SYSTEMS, AND METHODS FOR RESOLVING ELECTRONIC EXCITED STATES BANK OF AMERICA, N.A., AS ADMINISTRATIVE AGENT 2016-01-28 US disclosed
US-20160002200-A1 COMPOSITIONS, APPARATUS, SYSTEMS, AND METHODS FOR RESOLVING ELECTRONIC EXCITED STATES BANK OF AMERICA, N.A., AS ADMINISTRATIVE AGENT 2016-01-07 US disclosed
US-9145383-B2 Compositions, apparatus, systems, and methods for resolving electronic excited states HALLSTAR INNOVATIONS CORP. (US) 2015-09-29 US disclosed
US-20140044654-A1 COMPOSITIONS, APPARATUS, SYSTEMS, AND METHODS FOR RESOLVING ELECTRONIC EXCITED STATES HALLSTAR INNOVATIONS CORP. (US) 2014-02-13 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 (4 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-20160024046-A1 COMPOSITIONS, APPARATUS, SYSTEMS, AND METHODS FOR RESOLVING ELECTRONIC EXCITED STATES RECQL, BLM, WRN TSHR 4095/4885CES2 1265/4885CES1 2679/4885
US-20160002200-A1 COMPOSITIONS, APPARATUS, SYSTEMS, AND METHODS FOR RESOLVING ELECTRONIC EXCITED STATES RECQL, BLM, WRN TSHR 4095/4885CES2 1265/4885CES1 2679/4885
US-20140044654-A1 COMPOSITIONS, APPARATUS, SYSTEMS, AND METHODS FOR RESOLVING ELECTRONIC EXCITED STATES RECQL, BLM, WRN TSHR 4095/4885CES2 1265/4885CES1 2679/4885
US-20160022555-A1 COMPOSITIONS, APPARATUS, SYSTEMS, AND METHODS FOR RESOLVING ELECTRONIC EXCITED STATES RECQL, BLM, WRN TSHR 4095/4885CES2 1265/4885CES1 2679/4885

“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.