SCHEMBL26491069

SCHEMBL26491069

C#CCCCCOCc1ccc(NC(=O)C(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
SPHK1 Q9NYA1 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LTB4R Q15722 1/20 0.36
LMNA P02545 1/20 0.35
PTPN2 P17706 1/20 0.35

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
SCHEMBL26491074 0.83 CA12 (0.43) EPHX2NR1H4CA12CA1CA2
SCHEMBL26490217 0.75 MIF (0.42) MEN1KMT2A
SCHEMBL26491094 0.73 MEN1 (0.47) EPHX2NR1H4CA12CA1CA2
SCHEMBL26490237 0.70 TDP1 (0.36) CYP3A4MAPTALDH1A1RAB9A
SCHEMBL6744110 0.70 PPARA (0.43) EPHX2NR1H4SPHK1MEN1KMT2A
SCHEMBL3376445 0.70 TSHR (0.50) EPHX2
SCHEMBL5750540 0.70 CA12 (0.46) EPHX2NR1H4CA12CA1CA2
SCHEMBL11077344 0.70 CA12 (0.56) EPHX2NR1H4CA12CA1CA2
SCHEMBL23014897 0.69 L3MBTL1 (0.50) EPHX2CYP3A4ALDH1A1
SCHEMBL1422059 0.69 L3MBTL1 (0.50) EPHX2CYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230137943-A1 PHOTOPROXIMITY PROFILING OF PROTEIN-PROTEIN INTERACTIONS IN CELLS THE UNIVERSITY OF CHICAGO 2023-05-04 US disclosed
US-20230137943-A1 PHOTOPROXIMITY PROFILING OF PROTEIN-PROTEIN INTERACTIONS IN CELLS THE UNIVERSITY OF CHICAGO 2023-05-04 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-20230137943-A1 PHOTOPROXIMITY PROFILING OF PROTEIN-PROTEIN INTERACTIONS IN CELLS PPIA, S100A4, S100A6 EPHX2 3127/4885NR1H4 4505/4885CA12 2788/4885

“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.