SCHEMBL25108748

SCHEMBL25108748

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 1/20 0.37
▸ CES1 P23141 1/20 0.37
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ TAS1R3 Q7RTX0 1/20 0.34
▸ TAS1R1 Q7RTX1 1/20 0.34
▸ TAS1R2 Q8TE23 1/20 0.34
▸ SMN1; SMN2 Q16637 4/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ HTT P42858 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ NPC1 O15118 2/20 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
SCHEMBL25108827 0.84 ALDH1A1 (0.43) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL25107633 0.84 ALDH1A1 (0.46) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL25107612 0.81 LMNA (0.42) CES2CES1ALDH1A1MEN1KMT2A
SCHEMBL1299471 0.81 KCNQ3 (0.44) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL25108905 0.81 CES2 (0.37) CES2CES1HDAC1HDAC6ALDH1A1
SCHEMBL25107589 0.81 MAPT (0.50) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL23025106 0.80 KDM4E (0.50) CES2CES1ALDH1A1KDM4EGAA
SCHEMBL13171953 0.80 LMNA (0.41) HDAC1HDAC6ALDH1A1KDM4EGAA
SCHEMBL21807136 0.77 ALDH1A1 (0.36) CES2CES1HDAC1HDAC6ALDH1A1
SCHEMBL21804795 0.76 HCRTR2 (0.35) CES2CES1ALDH1A1GAASMN1; SMN2

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 CES2 2870/4885CES1 671/4885HDAC1 937/4885

“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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