SCHEMBL7080229

SCHEMBL7080229

O=C(O)C1N[C@H](c2ccccc2)[C@@H](c2ccccc2)N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
CHRNA7 P36544 1/20 0.42
EDNRA P25101 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GBA1 P04062 1/20 0.39
LMNA P02545 2/20 0.39
AKR1C3 P42330 1/20 0.38
AKR1C1 Q04828 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GAA P10253 2/20 0.38
MAPK1 P28482 1/20 0.38
MAPT P10636 1/20 0.38
HDAC4 P56524 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 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
SCHEMBL5531847 1.00 SMN1; SMN2 (0.47) SMN1; SMN2CHRNA7EDNRAMEN1KMT2A
SCHEMBL3009817 1.00 SMN1; SMN2 (0.47) SMN1; SMN2CHRNA7EDNRAMEN1KMT2A
SCHEMBL29543300 0.77 SMN1; SMN2 (0.47) SMN1; SMN2CHRNA7EDNRAMEN1KMT2A
SCHEMBL6769226 0.77 SMN1; SMN2 (0.47) SMN1; SMN2CHRNA7EDNRAMEN1KMT2A
SCHEMBL6769452 0.77 SMN1; SMN2 (0.47) SMN1; SMN2CHRNA7EDNRAMEN1KMT2A
SCHEMBL8700809 0.77 SMN1; SMN2 (0.47) SMN1; SMN2CHRNA7EDNRAMEN1KMT2A
SCHEMBL7385475 0.77 SMN1; SMN2 (0.47) SMN1; SMN2CHRNA7EDNRAMEN1KMT2A
SCHEMBL10537566 0.77 SMN1; SMN2 (0.61) SMN1; SMN2CHRNA7MEN1KMT2AGBA1
SCHEMBL30943497 0.77 SMN1; SMN2 (0.61) SMN1; SMN2CHRNA7MEN1KMT2AGBA1
SCHEMBL31146730 0.77 SMN1; SMN2 (0.61) SMN1; SMN2CHRNA7MEN1KMT2AGBA1

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-3896058-A2 ENANTIONSELECTIVE PROCESSES TO INSECTICIDAL 3-ARYL-3-TRIFLUOROMETHYL-SUBSTITUTED PYRROLIDINES SYNGENTA PARTICIPATIONS AG (CH) 2021-10-20 EP disclosed
EP-2763963-B1 ENANTIONSELECTIVE PROCESSES TO INSECTICIDAL 3-ARYL-3-TRIFLUOROMETHYL-SUBSTITUTED PYRROLIDINES SYNGENTA PARTICIPATIONS AG (CH) 2021-05-26 EP disclosed
US-9469633-B2 Processes for the preparation of pyrrolidine intermediates SYNGENTA PARTICIPATIONS AG (CH) 2016-10-18 US disclosed
US-20140296527-A1 PROCESSES FOR THE PREPARATION OF PYRROLIDINE INTERMEDIATES SYNGENTA PARTICIPATIONS AG (CH) 2014-10-02 US disclosed
US-20070276142-A1 Catalytic Asymmetric Synthesis of Optically Active Alpha-Halo-Carbonyl Compounds CHEMINOVA A/S (DK) 2007-11-29 US disclosed
US-20070276142-A1 Catalytic Asymmetric Synthesis of Optically Active Alpha-Halo-Carbonyl Compounds CHEMINOVA A/S (DK) 2007-11-29 US disclosed
WO-2003050105-A2 CATALYTIC ASYMMETRIC SYNTHESIS OF OPTICALLY ACTIVE COMPOUNDS CHEMINOVA A/S (DK) 2003-06-19 WO 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-20070276142-A1 Catalytic Asymmetric Synthesis of Optically Active Alpha-Halo-Carbonyl Compounds CBR1, CBR3, HAO1 SMN1; SMN2 4050/4885CHRNA7 1564/4885EDNRA 3029/4885
US-20140296527-A1 PROCESSES FOR THE PREPARATION OF PYRROLIDINE INTERMEDIATES PPOX, PRDX2, CBR1 SMN1; SMN2 3044/4885CHRNA7 3458/4885EDNRA 2086/4885

“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.