SCHEMBL4190356

SCHEMBL4190356

C[C@H](c1ccccc1)N1C[C@@](CO)(C(=O)O)CC1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.46
HSD11B1 P28845 3/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 3/20 0.38
ALDH1A1 P00352 2/20 0.36
CYP2D6 P10635 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
GRM2 Q14416 1/20 0.34
GRM3 Q14832 1/20 0.34
P2RX7 Q99572 1/20 0.34
METAP2 P50579 2/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
OPRL1 P41146 1/20 0.34
HPGD P15428 1/20 0.34
NPSR1 Q6W5P4 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
SCHEMBL14343034 0.87 KMT2A (0.42) KMT2AHSD11B1MAPT
SCHEMBL741948 0.86 KMT2A (0.43) KMT2AHSD11B1MAPTMAPK1ALDH1A1
SCHEMBL739249 0.86 KMT2A (0.43) KMT2AHSD11B1MAPTMAPK1ALDH1A1
SCHEMBL2670528 0.84 KMT2A (0.43) KMT2AHSD11B1MAPTMAPK1P2RX7
SCHEMBL3982824 0.84 KMT2A (0.41) KMT2AHSD11B1MAPTMAPK1ALDH1A1
SCHEMBL3976041 0.84 KMT2A (0.41) KMT2AHSD11B1MAPTMAPK1ALDH1A1
SCHEMBL8882312 0.83 NPSR1 (0.43) KMT2AMAPTMAPK1ALDH1A1NPSR1
SCHEMBL8880742 0.83 NPSR1 (0.43) KMT2AMAPTMAPK1ALDH1A1NPSR1
SCHEMBL8881380 0.83 NR3C2 (0.45) KMT2AMETAP2HPGD
SCHEMBL8881370 0.83 NR3C2 (0.45) KMT2AMETAP2HPGD

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
EP-1882689-B1 TRI- OR TETRA-SUBSTITUTED-3-AMINOPYRROLIDINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2013-07-10 EP disclosed
US-8476429-B2 Tri-, tetra-substituted-3-aminopyrrolidine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-07-02 US disclosed
US-20120232288-A1 TRI-, TETRA-SUBSTITUTED-3-AMINOPYRROLIDINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2012-09-13 US disclosed
US-8211910-B2 Tri-, tetra-substituted-3-aminopyrrolidine derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2012-07-03 US disclosed
EP-2463274-A1 Tri-or tetra-substituted-3-aminopyrrolidine deritatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-06-13 EP disclosed
US-20090253726-A1 TRI-, TETRA-SUBSTITUTED-3-AMINOPYRROLIDINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-10-08 US disclosed
EP-1882689-A1 TRI- OR TETRA-SUBSTITUTED-3-AMINOPYRROLIDINE DERIVATIVES Daiichi Sankyo Company, Limited (JP) 2008-01-30 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 (2 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-20090253726-A1 TRI-, TETRA-SUBSTITUTED-3-AMINOPYRROLIDINE DERIVATIVE AAAS, NPEPPS, TEAD4 KMT2A 3317/4885HSD11B1 4381/4885MAPT 2436/4885
US-20120232288-A1 TRI-, TETRA-SUBSTITUTED-3-AMINOPYRROLIDINE DERIVATIVE TLR5, TEAD4, NAALAD2 KMT2A 3178/4885HSD11B1 4462/4885MAPT 2807/4885

“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.