SCHEMBL23750164

SCHEMBL23750164

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

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ GABBR2 O75899 5/20 0.45
▸ GABBR1 Q9UBS5 5/20 0.45
▸ LMNA P02545 2/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ DRD3 P35462 1/20 0.45
▸ BLM P54132 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ THRB P10828 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ ADRA1D P25100 1/20 0.40
▸ TRPM8 Q7Z2W7 1/20 0.40

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
SCHEMBL23750200 1.00 HPGD (0.46) HPGDALDH1A1GABBR2GABBR1LMNA
SCHEMBL23750165 0.85 GABBR2 (0.47) HPGDALDH1A1GABBR2GABBR1LMNA
SCHEMBL23750201 0.85 GABBR2 (0.47) HPGDALDH1A1GABBR2GABBR1LMNA
SCHEMBL23750127 0.85 GABBR2 (0.47) HPGDALDH1A1GABBR2GABBR1LMNA
SCHEMBL23750203 0.85 GABBR2 (0.47) HPGDALDH1A1GABBR2GABBR1LMNA
SCHEMBL23750252 0.84 GABBR2 (0.46) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL23750381 0.84 GABBR2 (0.46) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL23750223 0.84 GABBR2 (0.46) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL23750382 0.84 GABBR2 (0.46) GABBR2GABBR1LMNACYP2C9MEN1
SCHEMBL21609308 0.83 GABBR2 (0.67) GABBR2GABBR1LMNACYP2C9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230012121-A1 COMPOUNDS SPERO THERAPEUTICS, INC. 2023-01-12 — — US disclosed
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 (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-20230012121-A1 COMPOUNDS MRPS18A, MRPL37, MRPL21 HPGD 2328/4885ALDH1A1 3966/4885GABBR2 4122/4885
US-20210246169-A1 COMPOUNDS MRPS18A, MRPL37, MRPS35 HPGD 2011/4885ALDH1A1 4011/4885GABBR2 4179/4885

“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.

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