SCHEMBL285910

SCHEMBL285910

Cc1onc(-c2ccc(F)cn2)c1C(O)Cc1ncc(C(=O)O)s1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 13/20 0.46
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
HCAR2 Q8TDS4 5/20 0.36

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
SCHEMBL286042 0.85 GABRA5 (0.44) GABRA5KMT2AATMHCAR2
SCHEMBL286101 0.82 GABRA5 (0.55) GABRA5HCAR2
SCHEMBL285780 0.74 GABRA5 (0.46) GABRA5KMT2AATMHCAR2
SCHEMBL285779 0.74 GABRA5 (0.46) GABRA5KMT2AATMHCAR2
SCHEMBL285805 0.73 GABRA5 (0.58) GABRA5
SCHEMBL16333264 0.72 GABRA5 (0.57) GABRA5KMT2A
SCHEMBL291608 0.71 GABRA5 (0.49) GABRA5
SCHEMBL285575 0.71 GABRA5 (0.51) GABRA5
SCHEMBL286265 0.70 GABRA5 (0.58) GABRA5
SCHEMBL27848512 0.69 GABRA5 (0.62) GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427459-B1 ISOXAZOLE-THIAZOLE DERIVATIVES AS GABA A RECEPTOR INVERSE AGONISTS FOR USE IN THE TREATMENT OF COGNITIVE DISORDERS HOFFMANN LA ROCHE (CH) 2016-09-28 EP disclosed
US-8178522-B2 Thiazoles HOFFMANN-LA ROCHE INC. (US) 2012-05-15 US disclosed
EP-2427459-A1 ISOXAZOLE-THIAZOLE DERIVATIVES AS GABA A RECEPTOR INVERSE AGONISTS FOR USE IN THE TREATMENT OF COGNITIVE DISORDERS F. Hoffmann-La Roche AG (CH) 2012-03-14 EP disclosed
WO-2010127974-A1 ISOXAZOLE-THIAZOLE DERIVATIVES AS GABA A RECEPTOR INVERSE AGONISTS FOR USE IN THE TREATMENT OF COGNITIVE DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2010-11-11 WO disclosed
US-20100286116-A1 THIAZOLES ROCHE PALO ALTO LLC 2010-11-11 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-20100286116-A1 THIAZOLES GABRA5, GABRA1, GABRA4 GABRA5 1/4885KMT2A 3573/4885ATM 3175/4885

“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.