SCHEMBL20139145

SCHEMBL20139145

FC(F)(F)Cn1nc(Br)nc1Oc1cccc(OC(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.36
F10 P00742 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
TRPC1 P48995 1/20 0.35
TRPC4 Q9UBN4 1/20 0.35
TRPC5 Q9UL62 1/20 0.35
DHFR P00374 1/20 0.34
S1PR1 P21453 1/20 0.34
SCN9A Q15858 3/20 0.34
PIM1 P11309 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
KCNH2 Q12809 1/20 0.33
GPR142 Q7Z601 1/20 0.33
RXRA P19793 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33
NOTUM Q6P988 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
SCHEMBL20139329 0.86 KDM4E (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL20141402 0.85 TEAD1 (0.43) PPARGCYP2C9
SCHEMBL20138714 0.85 AR (0.36) F10SLC6A2SLC6A4SLC6A3SCN9A
SCHEMBL20139044 0.81 F10 (0.40) PPARGF10TRPC1TRPC4TRPC5
SCHEMBL20139693 0.80 KCNJ6 (0.35) PPARGSLC6A4
SCHEMBL20142999 0.78 DGAT1 (0.30)
SCHEMBL20140248 0.78 F10 (0.38) PPARGF10TRPC1TRPC4TRPC5
SCHEMBL20154256 0.77 SOS1 (0.36) PPARGSLC6A4KCNH2
SCHEMBL20143008 0.76 NPBWR1 (0.36) SLC6A4SCN9AKCNH2
SCHEMBL20138673 0.73 NCOA1 (0.33) SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109790149-B Phenoxytriazoles 豪夫迈·罗氏有限公司 2022-05-17 CN disclosed
US-11319314-B2 Phenoxytriazoles HOFFMANN-LA ROCHE INC. (US) 2022-05-03 US disclosed
US-11319314-B2 Phenoxytriazoles HOFFMANN-LA ROCHE INC. (US) 2022-05-03 US disclosed
US-20210309653-A1 PHENOXYTRIAZOLES HOFFMANN-LA ROCHE INC. (US) 2021-10-07 US disclosed
US-20210309653-A1 PHENOXYTRIAZOLES HOFFMANN-LA ROCHE INC. (US) 2021-10-07 US disclosed
EP-3538516-B1 PHENOXYTRIAZOLES HOFFMANN LA ROCHE (CH) 2021-06-16 EP disclosed
EP-3538516-B1 PHENOXYTRIAZOLES HOFFMANN LA ROCHE (CH) 2021-06-16 EP disclosed
EP-3538516-A1 PHENOXYTRIAZOLES F. Hoffmann-La Roche AG (CH) 2019-09-18 EP disclosed
WO-2018087018-A1 PHENOXYTRIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2018-05-17 WO disclosed
WO-2018087018-A1 PHENOXYTRIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2018-05-17 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-20210309653-A1 PHENOXYTRIAZOLES HTT, PSEN1, APP PPARG 2002/4885F10 1528/4885SLC6A2 709/4885
US-11319314-B2 Phenoxytriazoles HTT, APP, PSEN1 PPARG 1140/4885F10 2673/4885SLC6A2 1080/4885

“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.