SCHEMBL25895698

SCHEMBL25895698

O=C(OCc1ccccc1)OC[C@@H]1CC[C@H](n2ccc(=O)[nH]c2=O)O1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DUT P33316 4/20 0.45
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NT5E P21589 1/20 0.39
P2RY12 Q9H244 5/20 0.39
P2RY2 P41231 5/20 0.39
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
MMP12 P39900 1/20 0.38
ABL1 P00519 1/20 0.37
RIN1 Q13671 1/20 0.37
P2RY6 Q15077 3/20 0.37
P2RY4 P51582 1/20 0.37

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
SCHEMBL10699768 0.86 DUT (0.47) DUTMEN1KMT2ANT5EP2RY12
SCHEMBL22666246 0.86 DUT (0.47) DUTMEN1KMT2ANT5EP2RY12
SCHEMBL21376704 0.85 ABL1 (0.46) DUTMEN1KMT2AABL1RIN1
SCHEMBL21376702 0.85 ABL1 (0.46) DUTMEN1KMT2AABL1RIN1
SCHEMBL10463851 0.85 ABL1 (0.46) DUTMEN1KMT2AABL1RIN1
SCHEMBL23808328 0.85 ABL1 (0.46) DUTMEN1KMT2AABL1RIN1
SCHEMBL10465192 0.85 ABL1 (0.46) DUTMEN1KMT2AABL1RIN1
SCHEMBL22110553 0.82 DUT (0.41) DUTP2RY2P2RY6P2RY4
SCHEMBL19236112 0.82 DUT (0.41) DUTP2RY2P2RY6P2RY4
SCHEMBL10513957 0.81 ABL1 (0.47) P2RY12ABL1RIN1

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-20230241224-A1 2'-ALKYL OR 3'- ALKYL MODIFIED RIBOSE DERIVATIVES AND METHODS OF USE SANEGENE BIO USA INC. 2023-08-03 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-20230241224-A1 2'-ALKYL OR 3'- ALKYL MODIFIED RIBOSE DERIVATIVES AND METHODS OF USE PARP1, PARP2, CD38 DUT 28/4885MEN1 2121/4885KMT2A 1421/4885

“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.