SCHEMBL2491074

SCHEMBL2491074

O=C1NC2(CC2)C(=O)N(Cc2ccccc2)C1CO

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
EHMT2 Q96KQ7 1/20 0.39
MEN1 O00255 3/20 0.38
HDAC2 Q92769 3/20 0.37
HDAC8 Q9BY41 3/20 0.37
HDAC6 Q9UBN7 3/20 0.37
LMNA P02545 2/20 0.37
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
GDA Q9Y2T3 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL1508627 0.86 KMT2A (0.48) KMT2AEHMT2MEN1CYP2C19MAPT
SCHEMBL22661899 0.86 KMT2A (0.48) KMT2AEHMT2MEN1CYP2C19MAPT
SCHEMBL1508566 0.86 KMT2A (0.48) KMT2AEHMT2MEN1CYP2C19MAPT
SCHEMBL1508950 0.81 KMT2A (0.50) KMT2AEHMT2MEN1LMNACYP2C19
SCHEMBL1508846 0.81 KMT2A (0.50) KMT2AEHMT2MEN1LMNACYP2C19
SCHEMBL22661866 0.81 KMT2A (0.50) KMT2AEHMT2MEN1LMNACYP2C19
SCHEMBL2489351 0.80 KMT2A (0.42) KMT2AEHMT2MEN1HDAC2HDAC8
SCHEMBL2492931 0.80 KMT2A (0.42) KMT2AEHMT2MEN1HDAC2HDAC8
SCHEMBL2487236 0.77 KMT2A (0.39) KMT2AMEN1MAPT
SCHEMBL2079073 0.73 HDAC8 (0.61) KMT2AEHMT2MEN1HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130172362-A1 Imidazothiazole Derivatives Having Proline Ring Structure DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-07-04 US disclosed
US-20130172362-A1 Imidazothiazole Derivatives Having Proline Ring Structure DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-07-04 US disclosed
US-20130172362-A1 Imidazothiazole Derivatives Having Proline Ring Structure DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-07-04 US disclosed
US-8404691-B2 Imidazothiazole derivatives having proline ring structure DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-03-26 US disclosed
US-8404691-B2 Imidazothiazole derivatives having proline ring structure DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-03-26 US disclosed
US-8404691-B2 Imidazothiazole derivatives having proline ring structure DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-03-26 US disclosed
EP-2380892-A1 IMIDAZOTHIAZOLE DERIVATIVE HAVING PROLINE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2011-10-26 EP 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-20130172362-A1 Imidazothiazole Derivatives Having Proline Ring Structure MDM2, TP53, TP53BP1 KMT2A 1912/4885EHMT2 3104/4885MEN1 3904/4885

“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.