SCHEMBL120274

SCHEMBL120274

O=C(O)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.61
▸ EPHX2 P34913 1/20 0.57
▸ FABP5 Q01469 3/20 0.52
▸ FABP7 O15540 2/20 0.52
▸ CASP3 P42574 2/20 0.50
▸ MDM4 O15151 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45

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
SCHEMBL21332462 0.92 KMT2A (0.66) KMT2AEPHX2FABP5FABP7CASP3
SCHEMBL8772818 0.88 KMT2A (0.58) KMT2AEPHX2FABP5FABP7CASP3
SCHEMBL27892188 0.88 KMT2A (0.58) KMT2AEPHX2FABP5FABP7CASP3
SCHEMBL3757636 0.86 KMT2A (0.72) KMT2AEPHX2FABP5FABP7CASP3
SCHEMBL28675945 0.86 KMT2A (0.59) KMT2AEPHX2FABP5FABP7CASP3
SCHEMBL2411832 0.86 KMT2A (0.63) KMT2AEPHX2FABP5FABP7CASP3
SCHEMBL28783421 0.85 KMT2A (0.56) KMT2AEPHX2FABP5FABP7CASP3
SCHEMBL4553478 0.84 KMT2A (0.63) KMT2AEPHX2FABP5FABP7CASP3
SCHEMBL30238049 0.83 KMT2A (0.64) KMT2AEPHX2FABP5FABP7CASP3
SCHEMBL1800381 0.83 KMT2A (0.64) KMT2AEPHX2FABP5FABP7CASP3

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10131658-B2 Anti-alphavbeta1 integrin compounds and methods THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-11-20 — — US disclosed
US-20180312500-A9 ANTI-ALPHAVBETA1 INTEGRIN COMPOUNDS AND METHODS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2018-11-01 — — US disclosed
US-20160376266-A1 ANTI-ALPHAVBETA1 INTEGRIN COMPOUNDS AND METHODS UNIV CALIFORNIA (US) 2016-12-29 — — US disclosed
CN-105154498-A Semi-recombinant preparation of GLP-1 analogues NOVO NORDISK AS 2015-12-16 — — CN disclosed
US-8895231-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-25 — — US disclosed
US-8895231-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-25 — — US disclosed
US-20120058428-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-08 — — US disclosed
US-20120058428-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-08 — — US disclosed
CN-101910193-A Semi-recombinant preparation method of GLP-1 analogue NOVO NORDISK AS 2010-12-08 — — CN disclosed
US-6252096-B1 PHOTOAFFINITY PROBE UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2001-06-26 — — 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 (3 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-20180312500-A9 ANTI-ALPHAVBETA1 INTEGRIN COMPOUNDS AND METHODS ITGB1, ITGAV, ITGA1 KMT2A 3854/4885EPHX2 2825/4885FABP5 2562/4885
US-10131658-B2 Anti-alphavbeta1 integrin compounds and methods ITGB1, ITGAV, ITGA1 KMT2A 3854/4885EPHX2 2825/4885FABP5 2562/4885
US-20160376266-A1 ANTI-ALPHAVBETA1 INTEGRIN COMPOUNDS AND METHODS ITGB1, ITGAV, ITGA1 KMT2A 3854/4885EPHX2 2825/4885FABP5 2562/4885

“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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