SCHEMBL581270

SCHEMBL581270

CCOC(=O)CC(=O)C1CCN(C(=O)OC)C(Cc2ccc(C(F)(F)F)cc2)C1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TACR1 P25103 7/20 0.40
P2RX3 P56373 1/20 0.36
CETP P11597 1/20 0.36
CYP3A4 P08684 2/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
TRPM2 O94759 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
SCHEMBL3074992 1.00 PPARG (0.43) PPARGKDM4EALDH1A1TACR1P2RX3
SCHEMBL582387 1.00 PPARG (0.43) PPARGKDM4EALDH1A1TACR1P2RX3
SCHEMBL3716846 0.91 PPARG (0.43) PPARGKDM4EALDH1A1TACR1CETP
SCHEMBL582515 0.91 MEN1 (0.42) KDM4EALDH1A1CYP3A4MAPTMEN1
SCHEMBL582047 0.91 MEN1 (0.42) KDM4EALDH1A1CYP3A4MAPTMEN1
SCHEMBL3073122 0.91 MEN1 (0.42) KDM4EALDH1A1CYP3A4MAPTMEN1
SCHEMBL582086 0.89 PPARG (0.40) PPARGKDM4EALDH1A1MAPTMAPK1
SCHEMBL3075705 0.89 PPARG (0.40) PPARGKDM4EALDH1A1MAPTMAPK1
SCHEMBL3075222 0.89 PPARG (0.40) PPARGKDM4EALDH1A1MAPTMAPK1
SCHEMBL581695 0.89 ALDH1A1 (0.45) ALDH1A1TACR1MAPK1MEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8415378-B2 Isoxazol-3(2H)-one analogs as therapeutic agents ASTRAZENECA AB (SE) 2013-04-09 US disclosed
EP-2417131-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS AstraZeneca AB (SE) 2012-02-15 EP disclosed
WO-2010117323-A1 METHOD AND APPARATUS FOR PRODUCING HEAT ENERGY AND CARBON DIOXIDE ASTRAZENECA AB (SE) 2010-10-14 WO disclosed
US-20100261755-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2010-10-14 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-20100261755-A1 ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS NR4A3, CBR3, OXER1 PPARG 1628/4885KDM4E 2668/4885ALDH1A1 2598/4885

“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.