SCHEMBL2670341

SCHEMBL2670341

C[C@H](c1ccccc1)N1C[C@@]2(C(=O)O)CC(F)C[C@H]2C1=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HSD11B1 P28845 2/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.36
CHRM2 P08172 3/20 0.36
CHRM4 P08173 3/20 0.36
CHRM5 P08912 3/20 0.36
CHRM1 P11229 3/20 0.36
CHRM3 P20309 3/20 0.36
MAPT P10636 1/20 0.35
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL2670345 1.00 KMT2A (0.43) KMT2AALDH1A1HPGDHSD11B1GAA
SCHEMBL4748829 1.00 KMT2A (0.43) KMT2AALDH1A1HPGDHSD11B1GAA
SCHEMBL4748823 0.86 KMT2A (0.41) KMT2AALDH1A1HPGDHSD11B1GAA
SCHEMBL2670503 0.86 KMT2A (0.41) KMT2AALDH1A1HPGDHSD11B1GAA
SCHEMBL2670504 0.86 KMT2A (0.41) KMT2AALDH1A1HPGDHSD11B1GAA
SCHEMBL4748838 0.81 ALDH1A1 (0.40) KMT2AALDH1A1HPGDHSD11B1GAA
SCHEMBL2670211 0.81 ALDH1A1 (0.40) KMT2AALDH1A1HPGDHSD11B1GAA
SCHEMBL4748037 0.80 KMT2A (0.43) KMT2AALDH1A1HPGDHSD11B1GAA
SCHEMBL2670175 0.79 KMT2A (0.42) KMT2AALDH1A1HPGDHSD11B1GAA
SCHEMBL2670141 0.79 KMT2A (0.45) KMT2AALDH1A1HPGDHSD11B1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140142096-A1 Fused Substituted Aminopyrrolidine Derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-05-22 US disclosed
US-8618094-B2 Fused substituted aminopyrrolidine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-12-31 US disclosed
EP-2097400-B1 FUSED SUBSTITUTED AMINOPYRROLIDINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2013-07-03 EP disclosed
US-20130029977-A9 Fused substituted aminopyrrolidine derivative DAIICHI SANKYO COMPANY, LIMITED 2013-01-31 US disclosed
EP-2540715-A1 Fused substituted aminopyrrolidine derivative Daiichi Sankyo Company, Limited (JP) 2013-01-02 EP disclosed
US-20120108582-A1 Fused substituted aminopyrrolidine derivative DAIICHI SANKYO COMPANY, LIMITED 2012-05-03 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-20120108582-A1 Fused substituted aminopyrrolidine derivative NQO2, QDPR, IL4I1 KMT2A 2847/4885ALDH1A1 2730/4885HPGD 983/4885
US-20140142096-A1 Fused Substituted Aminopyrrolidine Derivative NQO2, QDPR, IL4I1 KMT2A 2847/4885ALDH1A1 2730/4885HPGD 983/4885
US-20130029977-A9 Fused substituted aminopyrrolidine derivative NQO2, QDPR, IL4I1 KMT2A 2847/4885ALDH1A1 2730/4885HPGD 983/4885

“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.