SCHEMBL2803337

SCHEMBL2803337

CC(C)COc1cc(C(=O)O)ccc1Br

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 4/20 0.50
MAX P61244 4/20 0.50
EP300 Q09472 3/20 0.50
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
RXRG P48443 1/20 0.48
NR1H4 Q96RI1 4/20 0.47
PTGER1 P34995 1/20 0.46
HIF1A Q16665 2/20 0.46
TSHR P16473 1/20 0.45
XDH P47989 2/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
CA7 P43166 1/20 0.45
TPMT P51580 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45

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
SCHEMBL2803105 0.85 AR (0.53) MYCMAXHIF1ATSHRXDH
SCHEMBL2802978 0.84 TSHR (0.42) MYCMAXEP300TSHRCA12
SCHEMBL28607405 0.83 PTPN11 (0.51) MYCMAXEP300RXRARXRB
SCHEMBL15660519 0.83 MYC (0.54) MYCMAXEP300RXRARXRB
SCHEMBL1932820 0.82 TSHR (0.66) TSHRCA12CA1CA2CA4
SCHEMBL25484510 0.81 RXRA (0.68) MYCMAXEP300RXRARXRB
SCHEMBL17908022 0.81 TSHR (0.69) TSHRCA12CA1CA2CA4
SCHEMBL22442386 0.81 MYC (0.50) MYCMAXEP300RXRARXRB
SCHEMBL23793332 0.81 MYC (0.53) MYCMAXEP300RXRARXRB
SCHEMBL4275354 0.81 CA12 (0.67) MYCMAXTSHRCA12CA1

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
WO-2010132016-A1 BIS-(SULFONYLAMINO) DERIVATIVES FOR TREATMENT OF PAIN AND INFLAMMATION ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
WO-2010132016-A1 BIS-(SULFONYLAMINO) DERIVATIVES FOR TREATMENT OF PAIN AND INFLAMMATION ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 US disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 US disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 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-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy PTGER1, SULT2A1, SULT1E1 MYC 1809/4885MAX 2238/4885EP300 3286/4885

“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.