SCHEMBL19737552

SCHEMBL19737552

COc1ccc(-c2cn(S(=O)(=O)c3ccccc3)c3ccc(O)cc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 14/20 0.55
HTR2A P28223 3/20 0.53
HTR7 P34969 3/20 0.53
DRD2 P14416 3/20 0.53
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52
HTR1A P08908 1/20 0.52
HTR1D P28221 1/20 0.52
HTR1B P28222 1/20 0.52
HTR1E P28566 1/20 0.52
HTR1F P30939 1/20 0.52
DRD3 P35462 1/20 0.52
ESRRA P11474 1/20 0.51
PPARG P37231 2/20 0.51
PPARD Q03181 2/20 0.51
PPARA Q07869 2/20 0.51
ELAVL1 Q15717 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50

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
SCHEMBL19737625 0.89 HTR6 (0.53) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL19737507 0.88 HTR6 (0.71) HTR6CA12CA1CA2CA9
SCHEMBL19737472 0.87 HTR6 (0.66) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL1651879 0.87 HTR6 (0.74) HTR6HTR2AHTR7DRD2CA12
Dimethylamine SCHEMBL21222481 0.85 HTR6 (0.64) HTR6CA12CA1CA2CA9
SCHEMBL19737377 0.84 HTR6 (0.59) HTR6HTR7DRD2CA12CA1
Dimethylamine SCHEMBL21222407 0.83 HTR6 (0.65) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL19737624 0.82 HTR6 (0.63) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL19737555 0.80 HTR6 (0.59) HTR6HTR2AHTR7CA12CA1
SCHEMBL19737373 0.80 HTR6 (0.59) HTR6HTR7CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10689342-B2 Aza-tanshinone derivatives, process for their preparation and their use in therapy UNIVERSITA' DEGLI STUDI DI TRENTO (IT) 2020-06-23 US disclosed
US-10689342-B2 Aza-tanshinone derivatives, process for their preparation and their use in therapy UNIVERSITA' DEGLI STUDI DI TRENTO (IT) 2020-06-23 US disclosed
US-20190241516-A1 AZA-TANSHINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THERAPY UNIVERSITA' DEGLI STUDI DI TRENTO (IT) 2019-08-08 US disclosed
US-20190241516-A1 AZA-TANSHINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THERAPY UNIVERSITA' DEGLI STUDI DI TRENTO (IT) 2019-08-08 US disclosed
WO-2017216732-A1 AZA-TANSHINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THERAPY UNIVERSITA' DEGLI STUDI DI MILANO (IT) 2017-12-21 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 (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-20190241516-A1 AZA-TANSHINONE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THERAPY AZI2, TPMT, TYMS HTR6 1922/4885HTR2A 2850/4885HTR7 1603/4885
US-10689342-B2 Aza-tanshinone derivatives, process for their preparation and their use in therapy AZI2, TPMT, TYMS HTR6 1922/4885HTR2A 2850/4885HTR7 1603/4885

“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.