SCHEMBL23002608

SCHEMBL23002608

CC1(C)COC2(CCN(C(=O)O)CC2)C1=O

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 3/20 0.34
▸ CYP2C19 P33261 5/20 0.33
▸ MAPK1 P28482 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ CYP3A4 P08684 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ ALOX12 P18054 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ GFER P55789 1/20 0.30

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
SCHEMBL22814430 0.79 USP2 (0.46) USP2ALDH1A1HPGDLMNA
SCHEMBL22799231 0.71 — —
SCHEMBL22799232 0.71 — —
SCHEMBL22799234 0.71 — —
SCHEMBL23002533 0.70 ALDH1A1 (0.33) MAPK1ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL1313943 0.69 KMT2A (0.39) USP2CYP2C19MAPK1ALDH1A1MEN1
SCHEMBL15759336 0.68 FFAR3 (0.38) USP2CYP2C19MAPK1ALDH1A1CYP3A4
SCHEMBL5895020 0.68 GRIN2D (0.31) ALDH1A1
SCHEMBL19641323 0.67 FFAR3 (0.39) USP2CYP2C19MAPK1ALDH1A1CYP3A4
SCHEMBL31580621 0.67 GAA (0.31) ALDH1A1GAAGFER

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-11498930-B2 Pyrimidine-fused cyclic compound, preparation method therefor and application thereof Blueray Therapeutics (Shanghai) Co., Ltd (CN) 2022-11-15 — — US disclosed
US-20210053989-A1 PYRIMIDINE-FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHANGHAI BLUERAY BIOPHARMA CO., LTD. (CN) 2021-02-25 — — 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-11498930-B2 Pyrimidine-fused cyclic compound, preparation method therefor and application thereof PTPN11, PPM1F, PTPRF USP2 3618/4885CYP2C19 3558/4885MAPK1 318/4885
US-20210053989-A1 PYRIMIDINE-FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF PTPN11, PPM1F, PTPRF USP2 3618/4885CYP2C19 3558/4885MAPK1 318/4885

“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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