SCHEMBL20710654

SCHEMBL20710654

BNOCC(=O)NCCNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.57
▸ EPHX2 P34913 1/20 0.46
▸ FABP7 O15540 1/20 0.40
▸ FABP5 Q01469 1/20 0.40
▸ CASP3 P42574 2/20 0.40
▸ OPRD1 P41143 1/20 0.38
▸ CXCR2 P25025 1/20 0.38

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
SCHEMBL15147193 0.88 KMT2A (0.57) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL31490563 0.85 KMT2A (0.59) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL20193277 0.85 KMT2A (0.59) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL20193301 0.85 KMT2A (0.59) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL16790448 0.83 KMT2A (0.63) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL16790447 0.82 KMT2A (0.62) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL31490569 0.82 KMT2A (0.51) KMT2AEPHX2CASP3
SCHEMBL14008330 0.82 KMT2A (0.56) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL31652641 0.81 KMT2A (0.75) KMT2AEPHX2FABP7FABP5CASP3
SCHEMBL15147183 0.80 KMT2A (0.49) KMT2AEPHX2CASP3CXCR2

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-10667935-B2 Methods for making conjugates from disulfide-containing proteins NOVARTIS AG (CH) 2020-06-02 — — US disclosed
US-20190038444-A1 METHODS FOR MAKING CONJUGATES FROM DISULFIDE-CONTAINING PROTEINS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH INC. 2019-02-07 — — 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-20190038444-A1 METHODS FOR MAKING CONJUGATES FROM DISULFIDE-CONTAINING PROTEINS PDIA6, PTMS, PDIA3 KMT2A 1024/4885EPHX2 2024/4885FABP7 281/4885
US-10667935-B2 Methods for making conjugates from disulfide-containing proteins PDIA6, PTMS, PDIA3 KMT2A 1024/4885EPHX2 2024/4885FABP7 281/4885

“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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