SCHEMBL25107612

SCHEMBL25107612

C=C(C(=O)OC)c1cc(F)c(F)c(OC)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ TAS1R3 Q7RTX0 1/20 0.39
▸ TAS1R1 Q7RTX1 1/20 0.39
▸ TUBB1 Q9H4B7 4/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ CES2 O00748 1/20 0.37
▸ CES1 P23141 1/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ CYP2C19 P33261 2/20 0.37
▸ PTGES O14684 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ STAT3 P40763 1/20 0.36
▸ NFE2L2 Q16236 1/20 0.36
▸ TSHR P16473 2/20 0.36
▸ CA12 O43570 2/20 0.36

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
SCHEMBL25108827 0.84 ALDH1A1 (0.43) LMNARAB9ATAS1R3TAS1R1ALDH1A1
SCHEMBL25108748 0.81 CES2 (0.37) LMNAMAPK1HTTRAB9ATAS1R3
SCHEMBL29002168 0.80 MEN1 (0.50) MAPK1TUBB1CYP3A4ALDH1A1TPMT
SCHEMBL13171953 0.80 LMNA (0.41) LMNAMAPK1HTTRAB9APTGS2
SCHEMBL9066195 0.78 CYP1A2 (0.61) LMNAMAPK1CYP1A2CYP3A4CYP2C19
SCHEMBL8893830 0.78 CES2 (0.52) LMNAMAPK1HTTRAB9ATAS1R3
SCHEMBL6169559 0.78 HTT (0.62) LMNAMAPK1HTTRAB9APTGS2
SCHEMBL21804795 0.76 HCRTR2 (0.35) CES2CES1ALDH1A1
SCHEMBL8894645 0.75 CES2 (0.46) LMNAMAPK1HTTRAB9ACES2
SCHEMBL6558358 0.75 MEN1 (0.39) LMNAMAPK1PTGS2CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230065368-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X FORMA THERAPEUTICS, INC. 2023-03-02 — — 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-20230065368-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X USP9X, USP19, USP39 LMNA 4126/4885MAPK1 1832/4885HTT 2224/4885

“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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