SCHEMBL2363566

SCHEMBL2363566

COc1c(CBr)cccc1OCc1c(C)cccc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 5/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
HTR1A P08908 3/20 0.42
ADRA1D P25100 3/20 0.42
ADRA1A P35348 3/20 0.42
ADRA1B P35368 3/20 0.42
SGMS2 Q8NHU3 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SLC22A12 Q96S37 3/20 0.40
SCN8A Q9UQD0 1/20 0.38
TSHR P16473 2/20 0.37
MAPK1 P28482 2/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL1235314 0.85 ABCB1 (0.43) ABCB1ABCG2HTR1AADRA1DADRA1A
SCHEMBL1235214 0.83 CYP1A2 (0.43) HTR1AADRA1DADRA1AADRA1BSGMS2
SCHEMBL17237601 0.82 SMN1; SMN2 (0.48) ABCB1ABCG2HTR1AADRA1DADRA1A
SCHEMBL1235279 0.81 SGMS2 (0.42) ABCB1ABCG2HTR1AADRA1DADRA1A
SCHEMBL25173265 0.80 ABCB1 (0.57) ABCB1ABCG2HTR1AADRA1DADRA1A
SCHEMBL1235252 0.79 ABCB1 (0.41) ABCB1ABCG2HTR1AADRA1DADRA1A
SCHEMBL216572 0.78 SMN1; SMN2 (0.50) ABCB1ABCG2CYP1A2CYP3A4CYP2D6
SCHEMBL4513903 0.78 SCN4A (0.41) HTR1AADRA1DADRA1AADRA1BCYP1A2
SCHEMBL1233585 0.75 CA1 (0.47) HTR1AADRA1DADRA1AADRA1BSGMS2
SCHEMBL1233635 0.74 SLC22A12 (0.45) ABCB1ABCG2HTR1AADRA1DADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8410154-B2 Tetrazole compounds for reducing uric acid WELLSTAT THERAPEUTICS CORPORATION (US) 2013-04-02 US disclosed
US-20110206653-A1 TETRAZOLE COMPOUNDS FOR REDUCING URIC ACID WELLSTAT THERAPEUTICS CORPORATION (US) 2011-08-25 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-20110206653-A1 TETRAZOLE COMPOUNDS FOR REDUCING URIC ACID FPR1, CASP1, PON1 ABCB1 2221/4885ABCG2 1495/4885HTR1A 1090/4885

“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.