SCHEMBL19852387

SCHEMBL19852387

CC1COC2(C1)CN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
EPHX2 P34913 1/20 0.39
RECQL P46063 1/20 0.38
EPHX1 P07099 1/20 0.38
NR1H2 P55055 2/20 0.37
HPGD P15428 1/20 0.36
GPR119 Q8TDV5 3/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
RORC P51449 1/20 0.32
SPHK1 Q9NYA1 1/20 0.32

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
SCHEMBL16419547 0.89 USP2 (0.41) USP2SMN1; SMN2EPHX2RECQLEPHX1
SCHEMBL16419553 0.85 USP2 (0.46) USP2SMN1; SMN2EPHX2RECQLEPHX1
SCHEMBL21590971 0.85 USP2 (0.40) USP2SMN1; SMN2EPHX2RECQLEPHX1
SCHEMBL18481140 0.85 USP2 (0.46) USP2SMN1; SMN2EPHX2RECQLEPHX1
SCHEMBL21590680 0.85 RECQL (0.45) USP2SMN1; SMN2EPHX2RECQLEPHX1
SCHEMBL21590800 0.85 USP2 (0.41) USP2SMN1; SMN2EPHX2RECQLEPHX1
SCHEMBL21590661 0.85 USP2 (0.41) USP2SMN1; SMN2EPHX2RECQLEPHX1
SCHEMBL15777271 0.85 USP2 (0.41) USP2SMN1; SMN2EPHX2RECQLEPHX1
SCHEMBL23229956 0.84 USP2 (0.41) USP2SMN1; SMN2EPHX2RECQLEPHX1
SCHEMBL23410584 0.84 USP2 (0.41) USP2SMN1; SMN2EPHX2RECQLEPHX1

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
US-11840528-B2 Isoxazolyl ether derivatives as GABAA α5 PAM HOFFMANN-LA ROCHE INC. (US) 2023-12-12 US disclosed
EP-3807269-A1 NEW ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM F. Hoffmann-La Roche AG (CH) 2021-04-21 EP disclosed
US-20210094945-A1 NEW ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM HOFFMANN-LA ROCHE INC. (US) 2021-04-01 US disclosed
CN-112424196-A Novel isoxazolyl ether derivatives as GABAA alpha 5 PAM 豪夫迈·罗氏有限公司 2021-02-26 CN disclosed
WO-2019238633-A1 NEW ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM F. HOFFMANN-LA ROCHE AG (CH) 2019-12-19 WO disclosed
WO-2018026371-A1 DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS SUNOVION PHARMACEUTICALS INC. (US) 2018-02-08 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 (2 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-11840528-B2 Isoxazolyl ether derivatives as GABAA α5 PAM GABRA5, GABRA2, GABRB2 USP2 3807/4885SMN1; SMN2 3404/4885EPHX2 1292/4885
US-20210094945-A1 NEW ISOXAZOLYL ETHER DERIVATIVES AS GABA A ALPHA5 PAM GABRA5, GABRB2, GABRB1 USP2 3012/4885SMN1; SMN2 2455/4885EPHX2 1498/4885

“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.