SCHEMBL12793377

SCHEMBL12793377

CCCCNC(=O)CCc1ccc(C(OCCC(C)O)(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.58
▸ ALDH1A1 P00352 3/20 0.49
▸ KMT2A Q03164 3/20 0.48
▸ CNR1 P21554 2/20 0.48
▸ ATM Q13315 1/20 0.47
▸ MEN1 O00255 1/20 0.46

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
SCHEMBL12793380 0.83 POLB (0.57) POLBALDH1A1KMT2ACNR1MEN1
SCHEMBL28742538 0.82 POLB (0.86) POLBKMT2ACNR1MEN1
SCHEMBL12793379 0.80 POLB (0.55) POLBALDH1A1CNR1
SCHEMBL12793392 0.78 POLB (0.73) POLBALDH1A1KMT2ACNR1MEN1
SCHEMBL22291866 0.77 POLB (0.81) POLBALDH1A1CNR1
SCHEMBL14315813 0.76 ALDH1A1 (0.50) ALDH1A1CNR1
SCHEMBL12793394 0.74 POLB (0.71) POLBKMT2ACNR1MEN1
SCHEMBL13551205 0.74 ALDH1A1 (0.54) ALDH1A1KMT2ACNR1MEN1
SCHEMBL275229 0.74 POLB (0.80) POLBALDH1A1KMT2AATMMEN1
SCHEMBL17230525 0.74 POLB (0.75) POLBALDH1A1KMT2AATMMEN1

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-20110065196-A1 Trityl Derivatives for Enhancing Mass Spectrometry OXFORD GENE TECHNOLOGY IP LIMITED (GB) 2011-03-17 — — US disclosed
US-20110065196-A1 Trityl Derivatives for Enhancing Mass Spectrometry OXFORD GENE TECHNOLOGY IP LIMITED (GB) 2011-03-17 — — 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-20110065196-A1 Trityl Derivatives for Enhancing Mass Spectrometry PTMS, PTMA, TST POLB 2390/4885ALDH1A1 1386/4885KMT2A 3589/4885

“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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