SCHEMBL2598880

SCHEMBL2598880

CCOC(=O)C1OC(=O)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
POLB P06746 1/20 0.53
KDM4E B2RXH2 1/20 0.52
HSD17B10 Q99714 1/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
TDP1 Q9NUW8 1/20 0.49
CYP1A2 P05177 2/20 0.46
TSHR P16473 2/20 0.46
CYP2C19 P33261 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL3041384 0.87 TDP1 (0.46) ALDH1A1POLBKDM4EHSD17B10TDP1
SCHEMBL11104956 0.85 ALDH1A1 (0.67) ALDH1A1POLBKDM4EHSD17B10MEN1
SCHEMBL27974175 0.82 ALDH1A1 (0.52) ALDH1A1POLBKDM4EHSD17B10MEN1
SCHEMBL27974177 0.82 ALDH1A1 (0.47) ALDH1A1POLBKDM4EHSD17B10MEN1
SCHEMBL6303608 0.82 FABP7 (0.44) ALDH1A1HSD17B10KMT2ATDP1L3MBTL1
SCHEMBL11111593 0.79 ALDH1A1 (0.56) ALDH1A1POLBMEN1KMT2ATDP1
SCHEMBL29102630 0.79 POLB (0.45) ALDH1A1POLBKDM4EHSD17B10MEN1
SCHEMBL29004639 0.79 ALDH1A1 (0.46) ALDH1A1POLBKDM4EHSD17B10MEN1
SCHEMBL11110029 0.78 ALDH1A1 (0.55) ALDH1A1POLBMEN1KMT2ATDP1
SCHEMBL7970201 0.78 ALDH1A1 (0.41) ALDH1A1POLBKDM4EHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2571860-A1 2-PHENYL BENZOYLAMIDES Pfizer Inc (US) 2013-03-27 EP disclosed
US-20130072519-A1 2-PHENYL BENZOYLAMIDES CONN EDWARD LEE (US) 2013-03-21 US disclosed
US-20130072519-A1 2-PHENYL BENZOYLAMIDES CONN EDWARD LEE (US) 2013-03-21 US disclosed
US-20130072519-A1 2-PHENYL BENZOYLAMIDES CONN EDWARD LEE (US) 2013-03-21 US disclosed
WO-2011145022-A1 2-PHENYL BENZOYLAMIDES PFIZER INC. (US) 2011-11-24 WO disclosed
WO-2011145022-A1 2-PHENYL BENZOYLAMIDES PFIZER INC. (US) 2011-11-24 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 (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-20130072519-A1 2-PHENYL BENZOYLAMIDES APOB, MTTP, HADHB ALDH1A1 885/4885POLB 1395/4885KDM4E 3018/4885

“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.