SCHEMBL19765247

SCHEMBL19765247

C#CC(O)(c1cccc(Oc2ccccc2)c1)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 2/20 0.40
▸ AKR1C3 P42330 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ PDK2 Q15119 2/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ LTA4H P09960 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ PDK1 Q15118 1/20 0.38
▸ PDK3 Q15120 1/20 0.38
▸ PDK4 Q16654 1/20 0.38
▸ TLR8 Q9NR97 1/20 0.38
▸ TLR7 Q9NYK1 1/20 0.38
▸ NR3C1 P04150 1/20 0.37
▸ PGR P06401 1/20 0.37
▸ AR P10275 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ LOX P28300 1/20 0.37
▸ LOXL2 Q9Y4K0 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 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
SCHEMBL17974916 0.82 MAOB (0.41) CETPAKR1C3MAOBPDK2MAPK14
SCHEMBL611603 0.81 TSHR (0.42) TSHRCYP1A2CYP2C9CYP2C19NPSR1
SCHEMBL4433835 0.77 KCNN4 (0.43) NR3C1PGRESR2KIF11
SCHEMBL5669904 0.76 MAOB (0.47) CETPAKR1C3MAOBPDK2MAPK14
SCHEMBL9546526 0.76 L3MBTL1 (0.55) MAOBMAPK14LTA4HTSHRTLR8
SCHEMBL17963575 0.76 CA1 (0.44) KIF11
SCHEMBL17974972 0.76 PTPN1 (0.34) TSHR
SCHEMBL11404878 0.74 MAOB (0.48) AKR1C3MAOBPDK2MAPK14LTA4H
SCHEMBL17974959 0.73 PDK2 (0.43) PDK2PDK1PDK3PDK4NR3C1
SCHEMBL30101225 0.73 PDK2 (0.43) PDK2PDK1PDK3PDK4NR3C1

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
EP-3250571-B1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH INC (US) 2022-11-30 — — EP disclosed
US-10202378-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-12 — — US disclosed
US-10202378-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-12 — — US disclosed
US-20180009805-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-01-11 — — US disclosed
US-20180009805-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-01-11 — — 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 (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-10202378-B2 Therapeutic compounds and uses thereof TAF1, TAF1L, TAF1B CETP 1231/4885AKR1C3 1781/4885MAOB 3339/4885
US-20180009805-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF TAF1, TAF1L, TAF1B CETP 1231/4885AKR1C3 1781/4885MAOB 3339/4885

“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.

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