SCHEMBL1508950

SCHEMBL1508950

C[C@@H]1C(=O)NC2(CC2)C(=O)N1Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
ELANE P08246 2/20 0.41
EHMT2 Q96KQ7 1/20 0.41
SMO Q99835 2/20 0.40
MEN1 O00255 3/20 0.40
MAPT P10636 1/20 0.40
LMNA P02545 1/20 0.39
ALOX12 P18054 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD11B1 P28845 1/20 0.39
CYP2C19 P33261 2/20 0.39
CACNA1G O43497 1/20 0.39
CACNA1H O95180 1/20 0.39
CACNA1I Q9P0X4 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL22661866 1.00 KMT2A (0.50) KMT2AELANEEHMT2SMOMEN1
SCHEMBL1508846 1.00 KMT2A (0.50) KMT2AELANEEHMT2SMOMEN1
SCHEMBL1508566 0.83 KMT2A (0.48) KMT2AELANEEHMT2MEN1MAPT
SCHEMBL22661899 0.83 KMT2A (0.48) KMT2AELANEEHMT2MEN1MAPT
SCHEMBL1508627 0.83 KMT2A (0.48) KMT2AELANEEHMT2MEN1MAPT
SCHEMBL2491074 0.81 KMT2A (0.48) KMT2AEHMT2MEN1MAPTLMNA
SCHEMBL3106820 0.78 KMT2A (0.39) KMT2AELANEEHMT2SMOMEN1
SCHEMBL2492931 0.77 KMT2A (0.42) KMT2AELANEEHMT2MEN1MAPT
SCHEMBL2489351 0.77 KMT2A (0.42) KMT2AELANEEHMT2MEN1MAPT
SCHEMBL13297796 0.77 EHMT2 (0.49) KMT2AELANEEHMT2SMOMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11370800-B2 Process for the preparation of cyclopropyldiketopiperazines and of a key intermediate of DS-5272 F.I.S.—Fabbrica Italiana Sintetici S.p.A. (IT) 2022-06-28 US disclosed
EP-3580205-B1 PROCESS FOR THE PREPARATION OF CYCLOPROPYLDIKETOPIPERAZINES AND OF A KEY INTERMEDIATE OF DS-5272 FIS FABBRICA ITALIANA SINTETICI SPA (IT) 2021-05-05 EP disclosed
US-20200377521-A1 PROCESS FOR THE PREPARATION OF CYCLOPROPYLDIKETOPIPERAZINES AND OF A KEY INTERMEDIATE OF DS-5272 F.I.S. - FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2020-12-03 US disclosed
US-10836778-B2 Process for the preparation of cyclopropyldiketopiperazines and of a key intermediate of DS-5272 F.I.S.—Fabbrica Italiana Sintetici S.p.A. (IT) 2020-11-17 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-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
EP-2298778-A1 IMIDAZOTHIAZOLE DERIVATIVE HAVING 4,7-DIAZASPIROÝ2.5¨OCTANE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2011-03-23 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 (4 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 1912/4885ELANE 3250/4885EHMT2 3104/4885
US-10836778-B2 Process for the preparation of cyclopropyldiketopiperazines and of a key intermediate of DS-5272 DHPS, DUS2, RPS2 KMT2A 969/4885ELANE 4824/4885EHMT2 2616/4885
US-11370800-B2 Process for the preparation of cyclopropyldiketopiperazines and of a key intermediate of DS-5272 DHPS, DUS2, RPS2 KMT2A 969/4885ELANE 4824/4885EHMT2 2616/4885
US-20200377521-A1 PROCESS FOR THE PREPARATION OF CYCLOPROPYLDIKETOPIPERAZINES AND OF A KEY INTERMEDIATE OF DS-5272 DHPS, DUS2, RPS2 KMT2A 969/4885ELANE 4824/4885EHMT2 2616/4885

“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.