SCHEMBL2238142

SCHEMBL2238142

CCc1cc2c(cc1C(=O)N(C(C)C)[C@@H]1CCCN(C(=O)O)C1)N(CCCCOC)C(=O)C(C)(C)O2

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.38
KMT2A Q03164 2/20 0.36
POLB P06746 2/20 0.36
ALDH1A1 P00352 7/20 0.34
HPGD P15428 4/20 0.34
NPSR1 Q6W5P4 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 4/20 0.33
TP53 P04637 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
GAA P10253 2/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL2244538 0.98 REN (0.40) RENKMT2APOLBALDH1A1HPGD
SCHEMBL2242552 0.93 REN (0.40) RENKMT2APOLBALDH1A1HPGD
SCHEMBL2249042 0.92 KMT2A (0.38) RENKMT2APOLBALDH1A1HPGD
SCHEMBL2246871 0.91 REN (0.38) RENKMT2APOLBALDH1A1HPGD
SCHEMBL2241570 0.91 REN (0.37) RENKMT2APOLBALDH1A1HPGD
SCHEMBL2240761 0.91 REN (0.37) RENKMT2APOLBALDH1A1HPGD
SCHEMBL12353314 0.91 REN (0.37) RENKMT2APOLBALDH1A1HPGD
SCHEMBL2240819 0.91 REN (0.38) RENKMT2APOLBALDH1A1HPGD
SCHEMBL2242834 0.91 REN (0.38) RENKMT2APOLBALDH1A1HPGD
SCHEMBL2242350 0.90 REN (0.36) RENKMT2APOLBALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389511-B2 Bicyclic heterocyclic derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-03-05 US disclosed
US-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE DAINIPPON SUMITOMO PHARMA CO. 2011-08-04 US disclosed
EP-2243779-A1 BICYCLIC HETEROCYCLIC DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2010-10-27 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-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE REN, AGTR1, AGTR2 REN 1/4885KMT2A 1812/4885POLB 805/4885

“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.