SCHEMBL22589645

SCHEMBL22589645

CC(C)OC(=O)c1ccccc1CO[PH]1(O)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)C[C@@H]2O1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ DUT P33316 4/20 0.35
▸ CYP3A4 P08684 2/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ P2RY2 P41231 3/20 0.31
▸ CRBN Q96SW2 1/20 0.31
▸ P2RY12 Q9H244 1/20 0.31
▸ RNASE1 P07998 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ P2RY4 P51582 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
SCHEMBL22589720 0.85 CYP3A4 (0.41) MEN1KMT2ACYP3A4CYP2C9P2RY2
SCHEMBL22589644 0.80 DHFR (0.38) MEN1KMT2ADUTCYP3A4CYP2C9
SCHEMBL24625563 0.79 MEN1 (0.37) MEN1KMT2ADUTCYP3A4CYP2C9
SCHEMBL21178144 0.72 LMNA (0.45) —
SCHEMBL22589418 0.72 LMNA (0.38) —
SCHEMBL22801265 0.71 LMNA (0.41) RNASE1
SCHEMBL22801237 0.71 LMNA (0.43) —
SCHEMBL22801224 0.70 LMNA (0.39) —
SCHEMBL21179053 0.69 LMNA (0.41) —
SCHEMBL21178974 0.69 LMNA (0.44) —

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-20220220145-A1 CYCLIC PHOSPHATE COMPOUNDS CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2022-07-14 — — US disclosed
WO-2020219464-A1 CYCLIC PHOSPHATE COMPOUNDS LIGAND PHARMACEUTICALS, INC. (US) 2020-10-29 — — WO 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-20220220145-A1 CYCLIC PHOSPHATE COMPOUNDS PYGL, ALPP, PHPT1 MEN1 3120/4885KMT2A 4805/4885DUT 1927/4885

“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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