SCHEMBL1638205

SCHEMBL1638205

O=S(=O)(Oc1cccc(-c2ccccc2)c1OCc1ccccc1)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.43
RXRB P28702 2/20 0.43
RXRG P48443 2/20 0.43
PTGER1 P34995 8/20 0.41
PTGER4 P35408 5/20 0.41
PTGER3 P43115 5/20 0.41
PTGER2 P43116 5/20 0.41
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
FFAR1 O14842 2/20 0.38
GSTP1 P09211 1/20 0.38
PTPN1 P18031 1/20 0.37
PTPN6 P29350 1/20 0.37
MGLL Q99685 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
SCHEMBL9470568 0.84 DRD2 (0.39) TDP1L3MBTL1
SCHEMBL12646855 0.82 KDM4E (0.42) PTPN1
SCHEMBL1637318 0.81 RXRA (0.46) RXRARXRBRXRGMAPTMAPK1
SCHEMBL6640539 0.80 MAPT (0.55) RXRARXRBRXRGPTGER1PTGER4
SCHEMBL16072722 0.79 KCNA3 (0.46) RXRARXRBRXRGPTGER1MAPT
SCHEMBL21811791 0.78 PTGS2 (0.39) PTPN1
SCHEMBL367003 0.78 DRD2 (0.42) MAPK1TDP1L3MBTL1
SCHEMBL591400 0.78 MAPT (0.46) RXRARXRBRXRGMAPTMAPK1
SCHEMBL30718956 0.76 MAPT (0.46) RXRARXRBRXRGPTGER1MAPT
SCHEMBL30705191 0.76 DRD2 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541522-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-24 US disclosed
US-8541522-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-24 US disclosed
EP-2493932-A2 CATALYST COMPOUNDS AND USE THEREOF ExxonMobil Chemical Patents Inc. (US) 2012-09-05 EP disclosed
WO-2011056423-A2 CATALYST COMPOUNDS AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-05-12 WO disclosed
US-20110098429-A1 Catalyst Compounds and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2011-04-28 US disclosed
US-20110098429-A1 Catalyst Compounds and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2011-04-28 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 (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-20110098429-A1 Catalyst Compounds and Use Thereof ALOX12, THEM6, ALOX15 RXRA 1872/4885RXRB 2650/4885RXRG 1605/4885

“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.