SCHEMBL3073152

SCHEMBL3073152

CCOC(=O)CC(=O)[C@@H]1CCN(C(=O)OC)[C@H](Cc2ccc(Cl)cc2)C1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
TSHR P16473 1/20 0.45
ALDH1A1 P00352 3/20 0.40
KMT2A Q03164 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.39
CHIT1 Q13231 2/20 0.39
CHIA Q9BZP6 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL3069164 1.00 MAPT (0.45) MAPTTSHRALDH1A1KMT2ACYP1A2
SCHEMBL582142 1.00 MAPT (0.45) MAPTTSHRALDH1A1KMT2ACYP1A2
SCHEMBL3075705 0.90 PPARG (0.40) MAPTTSHRALDH1A1KMT2AMEN1
SCHEMBL582086 0.90 PPARG (0.40) MAPTTSHRALDH1A1KMT2AMEN1
SCHEMBL3075222 0.90 PPARG (0.40) MAPTTSHRALDH1A1KMT2AMEN1
SCHEMBL581342 0.90 NPSR1 (0.43) MAPTALDH1A1KMT2AMEN1GAA
SCHEMBL3072810 0.90 NPSR1 (0.43) MAPTALDH1A1KMT2AMEN1GAA
SCHEMBL3073450 0.90 NPSR1 (0.43) MAPTALDH1A1KMT2AMEN1GAA
SCHEMBL582515 0.88 MEN1 (0.42) MAPTALDH1A1KMT2ACYP3A4CYP2C19
SCHEMBL3073122 0.88 MEN1 (0.42) MAPTALDH1A1KMT2ACYP3A4CYP2C19

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-8415378-B2 Isoxazol-3(2H)-one analogs as therapeutic agents ASTRAZENECA AB (SE) 2013-04-09 US 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 MAPT 4513/4885TSHR 92/4885ALDH1A1 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.