SCHEMBL18095946

SCHEMBL18095946

COC(=O)C1CCN(C(=O)OC)CC12OCCO2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
EPHX2 P34913 2/20 0.33
USP2 O75604 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
TSHR P16473 1/20 0.32
PDK1 Q15118 1/20 0.31
MMP2 P08253 1/20 0.31
BRD4 O60885 1/20 0.31
BRDT Q58F21 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL3622678 0.88 EPHX1 (0.40) EPHX1SMN1; SMN2EPHX2USP2ALDH1A1
SCHEMBL3619623 0.88 MAPT (0.41) SMN1; SMN2ALDH1A1CYP2D6CYP2C9POLB
SCHEMBL14430917 0.86 EPHX1 (0.36) EPHX1USP2ALDH1A1CYP1A2CYP2D6
SCHEMBL3616921 0.81 EPHX1 (0.38) EPHX1USP2ALDH1A1CYP1A2CYP2D6
SCHEMBL14430918 0.80 THRB (0.36) EPHX1ALDH1A1POLBGAATSHR
SCHEMBL30108302 0.77 POLB (0.38) SMN1; SMN2USP2ALDH1A1CYP1A2CYP2D6
SCHEMBL711832 0.71 ATM (0.34) SMN1; SMN2CYP1A2CYP2C9TSHRCYP2C19
SCHEMBL9610 0.70 ATM (0.33) SMN1; SMN2ALDH1A1CYP1A2CYP2D6CYP2C9
SCHEMBL31597078 0.69 EPHX1 (0.38) EPHX1SMN1; SMN2USP2ALDH1A1CYP1A2
SCHEMBL3613755 0.68 USP2 (0.39) EPHX1SMN1; SMN2USP2ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11332478-B2 Manufacture of 4,5,6,7-tetrahydroisoxazolo[5,4-c]pyridin-3-ol H. LUNDBECK A/S (DK) 2022-05-17 US disclosed
US-20200223865-A1 MANUFACTURE OF 4,5,6,7-TETRAHYDROISOXAZOLO[5,4-C]PYRIDIN-3-OL H. LUNDBECK A/S (DK) 2020-07-16 US disclosed
US-10626123-B2 Manufacture of 4,5,6,7-tetrahydroisoxazolo[5,4-c]pyridin-3-ol H. LUNDBECK A/S (DK) 2020-04-21 US disclosed
EP-3274331-B1 MANUFACTURE OF 4,5,6,7-TETRAHYDROISOZAXOLO[5,4-C]PYRIDIN-3-OL H LUNDBECK AS (DK) 2020-02-26 EP disclosed
US-20180065984-A1 Manufacture of 4,5,6,7-tetrahydroisoxazolo[5,4-c]pyridin-3-ol H. LUNDBECK A/S (DK) 2018-03-08 US disclosed
EP-3274331-A1 MANUFACTURE OF 4,5,6,7-TETRAHYDROISOZAXOLO[5,4-C]PYRIDIN-3-OL H. Lundbeck A/S (DK) 2018-01-31 EP disclosed
WO-2016150953-A1 MANUFACTURE OF 4,5,6,7-TETRAHYDROISOZAXOLO[5,4-C]PYRIDIN-3-OL H. LUNDBECK A/S (DK) 2016-09-29 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 (4 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-11332478-B2 Manufacture of 4,5,6,7-tetrahydroisoxazolo[5,4-c]pyridin-3-ol GABRP, GABRD, GABRA5 EPHX1 663/4885SMN1; SMN2 2725/4885EPHX2 452/4885
US-10626123-B2 Manufacture of 4,5,6,7-tetrahydroisoxazolo[5,4-c]pyridin-3-ol GABRP, GABRA5, GABRD EPHX1 641/4885SMN1; SMN2 2707/4885EPHX2 440/4885
US-20200223865-A1 MANUFACTURE OF 4,5,6,7-TETRAHYDROISOXAZOLO[5,4-C]PYRIDIN-3-OL GABRP, GABRD, GABRA5 EPHX1 663/4885SMN1; SMN2 2725/4885EPHX2 452/4885
US-20180065984-A1 Manufacture of 4,5,6,7-tetrahydroisoxazolo[5,4-c]pyridin-3-ol GABRP, GABRA5, GABRD EPHX1 641/4885SMN1; SMN2 2707/4885EPHX2 440/4885

“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.