SCHEMBL14716358

SCHEMBL14716358

Cc1ccc(CCOS(=O)(=O)C(F)(F)F)cn1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.55
CA1 P00915 5/20 0.55
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
PLA2G7 Q13093 2/20 0.39
GAA P10253 1/20 0.38
NAMPT P43490 1/20 0.35
CA9 Q16790 1/20 0.35
SLC22A12 Q96S37 1/20 0.34
VNN1 O95497 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL1120466 0.81 TSHR (0.44) CA2CA1TSHRSMN1; SMN2MEN1
SCHEMBL14360354 0.80 CA2 (0.67) CA2CA1MEN1KMT2ACA9
SCHEMBL19281936 0.78 CA2 (0.53) CA2CA1CA9
SCHEMBL14360347 0.78 CA1 (0.52) CA2CA1CA9
SCHEMBL7219948 0.77 CA2 (0.49) CA2CA1SMN1; SMN2MEN1LMNA
SCHEMBL121411 0.75 CA1 (0.40) CA2CA1TSHRSMN1; SMN2MEN1
SCHEMBL23291910 0.74 CA2 (0.69) CA2CA1CA9
SCHEMBL6586107 0.74 CA2 (0.68) CA2CA1CA9
SCHEMBL17589157 0.73 POLB (0.35) CA2CA1LMNAGAASLC22A12
SCHEMBL5496662 0.73 CA2 (0.67) CA2CA1MEN1KMT2ACA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9550782-B2 Compounds and methods for treating diabetes MEDIVATION TECHNOLOGIES, INC. (US) 2017-01-24 US disclosed
US-9527854-B2 Compounds and methods for treatment of hypertension MEDIVATION TECHNOLOGIES, INC. (US) 2016-12-27 US disclosed
US-20150266884-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HYPERTENSION MEDIVATION TECHNOLOGIES, INC. 2015-09-24 US disclosed
US-9006263-B2 Compounds and methods for treatment of hypertension MEDIVATION TECHNOLOGIES, INC. (US) 2015-04-14 US disclosed
US-8815843-B2 Compounds and methods of treating diabetes MEDIVATION TECHNOLOGIES, INC. (US) 2014-08-26 US disclosed
US-8791132-B2 Compounds and methods for treatment of hypertension MEDIVATION TECHNOLOGIES, INC. (US) 2014-07-29 US disclosed
US-20140088086-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HYPERTENSION MEDIVATION TECHNOLOGIES, INC. (US) 2014-03-27 US disclosed
CN-103476416-A Compounds and methods for treatment of hypertension MEDIVATION TECHNOLOGIES INC 2013-12-25 CN disclosed
CN-103476417-A Compounds and methods of treating diabetes MEDIVATION TECHNOLOGIES INC 2013-12-25 CN disclosed
US-20130190294-A1 COMPOUNDS AND METHODS FOR TREATING DIABETES MEDIVATION TECHNOLOGIES, INC. (US) 2013-07-25 US disclosed
US-20130053366-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HYPERTENSION MEDIVATION TECHNOLOGIES, INC. 2013-02-28 US disclosed
US-20130053367-A1 COMPOUNDS AND METHODS OF TREATING DIABETES MEDIVATION TECHNOLOGIES, INC. 2013-02-28 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 (5 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-20130053366-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HYPERTENSION ADRB2, ADRA2B, ADRB1 CA2 553/4885CA1 3781/4885TSHR 264/4885
US-20130190294-A1 COMPOUNDS AND METHODS FOR TREATING DIABETES ADRB2, ADRA2B, ADRA2C CA2 836/4885CA1 3982/4885TSHR 97/4885
US-20150266884-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HYPERTENSION ADRB2, ADRA2B, ADRB1 CA2 553/4885CA1 3781/4885TSHR 264/4885
US-20140088086-A1 COMPOUNDS AND METHODS FOR TREATMENT OF HYPERTENSION ADRB2, ADRA2B, ADRB1 CA2 553/4885CA1 3781/4885TSHR 264/4885
US-20130053367-A1 COMPOUNDS AND METHODS OF TREATING DIABETES ADRB2, ADRA2B, ADRA2C CA2 815/4885CA1 3962/4885TSHR 97/4885

“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.