SCHEMBL3974273

SCHEMBL3974273

COC(=O)c1cc(C(=O)c2c(-c3ccc(Cl)cc3)noc2C)c[nH]1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.53
ALDH1A1 P00352 4/20 0.53
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
GPBAR1 Q8TDU6 4/20 0.48
GABRA5 P31644 1/20 0.47
KDM4E B2RXH2 1/20 0.45
TSHR P16473 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TP53 P04637 1/20 0.45
GAA P10253 1/20 0.45
GHSR Q92847 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL14546845 0.91 SMN1; SMN2 (0.53) LMNAALDH1A1HTTSMN1; SMN2GPBAR1
SCHEMBL3976829 0.89 HTT (0.52) LMNAALDH1A1HTTSMN1; SMN2GPBAR1
SCHEMBL3978223 0.89 RAB9A (0.53) LMNAALDH1A1HTTSMN1; SMN2KDM4E
SCHEMBL3977666 0.89 LMNA (0.53) LMNAALDH1A1HTTSMN1; SMN2GPBAR1
SCHEMBL3982594 0.89 SMN1; SMN2 (0.63) LMNAALDH1A1HTTSMN1; SMN2KDM4E
SCHEMBL3977478 0.89 ALDH1A1 (0.55) LMNAALDH1A1HTTSMN1; SMN2GPBAR1
SCHEMBL3976793 0.88 HTT (0.54) LMNAALDH1A1HTTSMN1; SMN2GPBAR1
SCHEMBL3977188 0.85 SMN1; SMN2 (0.55) LMNAALDH1A1HTTSMN1; SMN2KDM4E
SCHEMBL3977280 0.83 ALDH1A1 (0.54) LMNAALDH1A1HTTSMN1; SMN2GPBAR1
SCHEMBL3974280 0.83 ALDH1A1 (0.58) LMNAALDH1A1SMN1; SMN2GPBAR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538132-B2 Isoxazolo derivatives HOFFMAN-LA ROCHE INC. (US) 2009-05-26 US disclosed
US-7538132-B2 Isoxazolo derivatives HOFFMAN-LA ROCHE INC. (US) 2009-05-26 US disclosed
US-7538132-B2 Isoxazolo derivatives HOFFMAN-LA ROCHE INC. (US) 2009-05-26 US disclosed
EP-1931661-B1 ISOXAZOLO DERIVATIVES AS GABA A ALPHA5 INVERSE AGONISTS HOFFMANN LA ROCHE (CH) 2008-11-19 EP disclosed
EP-1931661-A1 ISOXAZOLO DERIVATIVES AS GABA A ALPHA5 INVERSE AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2008-06-18 EP disclosed
WO-2007039389-A1 ISOXAZOLO DERIVATIVES AS GABA A ALPHA5 INVERSE AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2007-04-12 WO disclosed
US-20070066668-A1 Isoxazolo derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-03-22 US disclosed
US-20070066668-A1 Isoxazolo derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-03-22 US disclosed
US-20070066668-A1 Isoxazolo derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-03-22 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-20070066668-A1 Isoxazolo derivatives GABRA5, GABRA4, GABRA1 LMNA 4188/4885ALDH1A1 435/4885HTT 2677/4885

“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.