SCHEMBL23750262

SCHEMBL23750262

CC(C)C(=O)C[C@H](CN)c1cccc(-c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GABBR2 O75899 2/20 0.51
▸ GABBR1 Q9UBS5 2/20 0.51
▸ RXRA P19793 1/20 0.46
▸ RXRB P28702 1/20 0.46
▸ RXRG P48443 1/20 0.46
▸ CTSA P10619 2/20 0.42
▸ CTSL P07711 1/20 0.42
▸ CTSS P25774 1/20 0.42
▸ CTSK P43235 1/20 0.42
▸ CFD P00746 1/20 0.40
▸ F11 P03951 1/20 0.40
▸ TPSB2 P20231 1/20 0.40
▸ CHRNB2 P17787 1/20 0.40
▸ CHRNA4 P43681 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ PTGS2 P35354 1/20 0.39
▸ AOC3 Q16853 1/20 0.39

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
SCHEMBL23750267 1.00 GABBR2 (0.51) GABBR2GABBR1RXRARXRBRXRG
SCHEMBL23750264 0.85 GABBR2 (0.54) GABBR2GABBR1RXRARXRBRXRG
SCHEMBL23750265 0.85 GABBR2 (0.54) GABBR2GABBR1RXRARXRBRXRG
SCHEMBL23750253 0.84 PRMT6 (0.39) GABBR2GABBR1RXRARXRBRXRG
SCHEMBL23750251 0.84 PRMT6 (0.39) GABBR2GABBR1RXRARXRBRXRG
SCHEMBL23750203 0.84 GABBR2 (0.47) GABBR2GABBR1RXRARXRBRXRG
SCHEMBL23750127 0.84 GABBR2 (0.47) GABBR2GABBR1RXRARXRBRXRG
SCHEMBL24879115 0.83 GABBR2 (0.51) GABBR2GABBR1RXRARXRBRXRG
SCHEMBL23750382 0.82 GABBR2 (0.46) GABBR2GABBR1GAAAOC3
SCHEMBL23750223 0.82 GABBR2 (0.46) GABBR2GABBR1GAAAOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210246169-A1 COMPOUNDS SPERO THERAPEUTICS, INC. (US) 2021-08-12 — — 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-20210246169-A1 COMPOUNDS MRPS18A, MRPL37, MRPS35 GABBR2 4179/4885GABBR1 4092/4885RXRA 1251/4885

“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.

Send feedback