SCHEMBL30112012

SCHEMBL30112012

CC(C)(C)OC(=O)c1cc(N2CC(O)C2)ccn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRG2 P18507 11/20 0.38
▸ GABRB3 P28472 11/20 0.38
▸ GABRA5 P31644 10/20 0.38
▸ GABRA1 P14867 10/20 0.38
▸ GABRA2 P47869 10/20 0.38
▸ GABRA3 P34903 9/20 0.38
▸ GABRA6 Q16445 8/20 0.38
▸ GABRA4 P48169 5/20 0.38
▸ GABRP O00591 1/20 0.38
▸ GABRD O14764 1/20 0.38
▸ GABRB1 P18505 1/20 0.38
▸ GABRB2 P47870 1/20 0.38
▸ GABRE P78334 1/20 0.38
▸ GABRG1 Q8N1C3 1/20 0.38
▸ GABRG3 Q99928 1/20 0.38
▸ GABRQ Q9UN88 1/20 0.38
▸ RAF1 P04049 1/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ USP30 Q70CQ3 2/20 0.34
▸ ACACB O00763 1/20 0.34

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
SCHEMBL19555968 1.00 GABRG2 (0.38) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL30489405 0.79 OPRM1 (0.39) USP30
SCHEMBL31704863 0.73 MAPT (0.51) GPR119
SCHEMBL11363885 0.73 MAPT (0.51) GPR119
SCHEMBL13105640 0.72 GABRG2 (0.46) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL29563011 0.72 GABRG2 (0.46) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL3700486 0.72 GABRG2 (0.46) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL163615 0.72 GABRG2 (0.46) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL5226281 0.72 CFTR (0.49) —
SCHEMBL724883 0.71 ALDH1A1 (0.50) GABRG2GABRB3GABRA5GABRA1GABRA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3710428-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2026-03-25 — — EP disclosed
CN-112204009-B Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2024-05-07 — — CN disclosed
CN-109641854-B Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2023-02-03 — — CN disclosed
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