SCHEMBL4477436

SCHEMBL4477436

CCOC(=O)c1c2ccc(OCc3ccc(C(=O)O)cc3)cc2n2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.64
ALDH1A1 P00352 5/20 0.64
MAPT P10636 5/20 0.64
MEN1 O00255 5/20 0.64
KDM4E B2RXH2 4/20 0.64
SAE1 Q9UBE0 2/20 0.64
UBA2 Q9UBT2 2/20 0.64
APAF1 O14727 1/20 0.64
G6PD P11413 1/20 0.64
PABPC1 P11940 1/20 0.64
CACNA1B Q00975 1/20 0.64
APBA1 Q02410 1/20 0.64
LMNA P02545 1/20 0.56
HPGD P15428 1/20 0.56
XBP1 P17861 1/20 0.56
MPI P34949 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.54
GAA P10253 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54

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
SCHEMBL366970 0.93 KMT2A (0.70) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL364783 0.91 ALDH1A1 (0.67) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL364673 0.89 ALDH1A1 (0.65) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL367033 0.87 KMT2A (0.62) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL364181 0.85 ALDH1A1 (0.65) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL366339 0.84 KMT2A (0.64) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL4477445 0.84 RXRA (0.50) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL365354 0.84 ALDH1A1 (0.61) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL364481 0.83 ALDH1A1 (0.66) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL366986 0.83 ALDH1A1 (0.77) KMT2AALDH1A1MAPTMEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050004369-A1 Phenyl substituted carboxylic acids INSTITUTES FOR PHARMACEUTICAL DISCOVERY, L.L.C. 2005-01-06 US claimed
US-7524878-B2 Phenyl substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICALS DISCOVERY LLC (US) 2009-04-28 US disclosed
US-20050004369-A1 Phenyl substituted carboxylic acids INSTITUTES FOR PHARMACEUTICAL DISCOVERY, L.L.C. 2005-01-06 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-20050004369-A1 Phenyl substituted carboxylic acids PTPA, PTPRS, PTPRO KMT2A 1897/4885ALDH1A1 209/4885MAPT 1749/4885

“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.