SCHEMBL24971645

SCHEMBL24971645

Cc1ccc2oc(=O)n(CC(P)(P)P)c2c1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 4/20 0.59
▸ CD74 P04233 2/20 0.59
▸ KMT2A Q03164 3/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ POLB P06746 2/20 0.58
▸ ALDH1A1 P00352 2/20 0.56
▸ RAB9A P51151 3/20 0.53
▸ TSHR P16473 2/20 0.52
▸ LMNA P02545 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ TP53 P04637 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ THRB P10828 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL16948384 0.85 KMT2A (0.60) MIFCD74KMT2AMEN1POLB
SCHEMBL16948382 0.84 MIF (0.58) MIFCD74KMT2AMEN1POLB
SCHEMBL13367744 0.81 MIF (0.66) MIFCD74KMT2AMEN1POLB
SCHEMBL24973072 0.79 MIF (0.59) MIFCD74KMT2AMEN1POLB
SCHEMBL16141179 0.77 ALDH1A1 (0.64) MIFCD74KMT2AMEN1POLB
SCHEMBL14198764 0.77 MIF (0.65) MIFCD74KMT2AMEN1POLB
SCHEMBL16948413 0.76 MIF (0.59) MIFCD74KMT2AMEN1POLB
SCHEMBL16948291 0.76 KMT2A (0.64) MIFCD74KMT2AMEN1POLB
SCHEMBL5289472 0.76 MIF (0.63) MIFCD74KMT2AMEN1POLB
SCHEMBL16250472 0.75 HPGD (0.64) MIFCD74KMT2AMEN1POLB

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-20230033573-A1 CERTAIN (2S)-N-[(1S)-1-CYANO-2-PHENYLETHYL]-1,4-OXAZEPANE-2-CARBOXAMIDES AS DIPEPTIDYL PEPTIDASE 1 INHIBITORS BIOPHARMA CREDIT PLC (GB) 2023-02-02 — — 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-20230033573-A1 CERTAIN (2S)-N-[(1S)-1-CYANO-2-PHENYLETHYL]-1,4-OXAZEPANE-2-CARBOXAMIDES AS DIPEPTIDYL PEPTIDASE 1 INHIBITORS DPP4, DPP7, DPEP1 MIF 4062/4885CD74 3393/4885KMT2A 1794/4885

“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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